Anthony Charles Legon
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Chemistry
Anthony Charles Legon's Degrees
- Bachelors Chemistry University of California, Berkeley
- PhD Chemistry Stanford University
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(Suggest an Edit or Addition)Anthony Charles Legon's Published Works
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Total number of citations to an author for the works they published in a given year. This highlights publication of the most important work(s) by the author
Published Works
- Definition of the hydrogen bond (IUPAC Recommendations 2011) (2011) (1126)
- Definition of the halogen bond (IUPAC Recommendations 2013) (2013) (1085)
- Defining the hydrogen bond: An account (IUPAC Technical Report) (2011) (710)
- The halogen bond: an interim perspective. (2010) (519)
- Prereactive Complexes of Dihalogens XY with Lewis Bases B in the Gas Phase: A Systematic Case for the Halogen Analogue B⋅⋅⋅XY of the Hydrogen Bond B⋅⋅⋅HX (1999) (504)
- Halogen bonding: a new interaction for liquid crystal formation. (2004) (450)
- Angular geometries and other properties of hydrogen-bonded dimers: a simple electrostatic interpretation of the success of the electron-pair model (1987) (241)
- Gas-phase spectroscopy and the properties of hydrogen-bonded dimers. HCN.cntdot..cntdot..cntdot.HF as the spectroscopic prototype (1986) (241)
- Definition of the chalcogen bond (IUPAC Recommendations 2019) (2019) (203)
- Determination of properties of hydrogen-bonded dimers by rotational spectroscopy and a classfication of dimer geometries (1982) (196)
- Directional character, strength, and nature of the hydrogen bond in gas-phase dimers (1987) (174)
- Equilibrium conformations of four- and five-membered cyclic molecules in the gas phase: determination and classification (1980) (165)
- PULSED-NOZZLE, FOURIER-TRANSFORM MICROWAVE SPECTROSCOPY OF WEAKLY BOUND DIMERS (1983) (154)
- The rotational spectrum and molecular structure of the acetylene–HCl dimer (1981) (149)
- Tetrel, pnictogen and chalcogen bonds identified in the gas phase before they had names: a systematic look at non-covalent interactions. (2017) (141)
- Hydrogen bonding as a probe of electron densities: limiting gas-phase nucleophilicities and electrophilicities of B and HX (1987) (122)
- π‐Electron “Donor–Acceptor” Complexes B⋅⋅⋅ClF and the Existence of the “Chlorine Bond” (1998) (114)
- Spectroscopic investigations of hydrogen bonding interactions in the gas phase. I. The determination of the geometry, dissociation energy, potential constants and electric dipole moment of the hydrogen-bonded heterodimer HCN • • • HF from its microwave rotational spectrum (1980) (111)
- The rotational spectrum, H, 19F nuclear spin–nuclear spin coupling, D nuclear quadrupole coupling, and molecular geometry of a weakly bound dimer of carbon monoxide and hydrogen fluoride (1981) (107)
- The microwave rotational spectrum, molecular geometry, 14N nuclear quadrupole coupling constants, and H, 19F nuclear spin–nuclear spin coupling constant of the nitrogen–hydrogen fluoride dimer (1982) (105)
- Rotational spectrum of (CH3)3P⋯HCl and a comparison of properties within the series of axially symmetric dimers R3Y⋯HCl, where Y = N or P and R = H or CH3 (1990) (104)
- The rotational spectrum, structure, and molecular properties of the ethylene–HCl dimer (1981) (102)
- Identification and molecular geometry of a weakly bound dimer (H2O, HC1 in the gas phase by rotational spectroscopy (1983) (100)
- The nature of ammonium and methylammonium halides in the vapour phase: hydrogen bonding versus proton transfer (1993) (97)
- Definition of the Hydrogen Bond (2010) (89)
- The hydrogen cyanide dimer: Identification and structure from microwave spectroscopy (1977) (85)
- The Interaction of Dihalogens and Hydrogen Halides with Lewis Bases in the Gas Phase: An Experimental Comparison of the Halogen Bond and the Hydrogen Bond (2007) (84)
- Microwave rotational spectrum, molecular geometry, and intermolecular interaction potential of the hydrogen‐bonded dimer OC–HCl (1981) (83)
- Tilden Lecture. The properties of hydrogen-bonded dimers from rotational spectroscopy (1990) (82)
- Nature, geometry, and binding strength of the ammonia–hydrogen chloride dimer determined from the rotational spectrum of ammonium chloride vapor (1988) (81)
- Rotational spectra and geometries of the gas-phase dimers (CH4,HF) and (CH4,HCl) (1990) (79)
- Systematic effect of d substitution on hydrogen-bond lengths in gas-phase dimers B…HX and a model for its interpretation (1988) (65)
- The rotational spectrum and molecular properties of a hydrogen‐bonded complex formed between hydrogen cyanide and hydrogen chloride (1982) (65)
- The rotational spectrum of 15N-ammonium chloride vapour: characterisation of the hydrogen-bonded dimer H3N...HCl (1986) (61)
- Defining the hydrogen bond: an account (2011) (61)
- Equilibrium nuclear quadrupole coupling constants from the rotational spectrum of BrCl: a source of the electric quadrupole moment ratios Q ( 79 Br)/ Q ( 81 Br) and Q ( 35 Cl)/ Q ( 37 Cl) (1993) (60)
- Mulliken n.aσ and bπ.aσ complexes B…Cl2 in the gas phase: rules for predicting angular geometries and nature of the interaction (1995) (60)
- The properties of the hydrogen‐bonded dimer (CH3)3N⋅⋅⋅HCN from an investigation of its rotational spectrum (1988) (59)
- The rotational spectrum and molecular properties of a hydrogen-bonded dimer of phosphine and hydrogen fluoride (1983) (56)
- The rotational spectra of weakly bound dimers of carbon monoxide and the hydrogen halides HX (X=F, Cl, and Br) (1980) (55)
- Rotational spectra and structures of van der Waals dimers of Ar with a series of fluorocarbons: Ar⋅⋅⋅CH2CHF, Ar⋅⋅⋅CH2CF2, and Ar⋅⋅⋅CHFCF2 (1991) (54)
- Principles of molecular recognition (1993) (54)
- The rotational spectrum and molecular geometry of the cyclopropane–HF dimer (1981) (51)
- An investigation of the hydrogen‐bonded dimer H3N⋅⋅⋅HBr by pulsed‐nozzle, Fourier‐transform microwave spectroscopy of ammonium bromide vapor (1987) (51)
- Isolation of H2S…ClF in a pre-reactive mixture of H2S and ClF expanded in a coaxial jet and characterisation by rotational spectroscopy (1995) (51)
- Rotational spectrum, structure, and chlorine nuclear quadrupole tensor of the vinyl fluoride–HCl dimer (1990) (51)
- Rotational spectrum of a short‐lived dimer of oxirane and hydrogen chloride: Evidence for a bent hydrogen bond (1992) (50)
- On the directionality and non-linearity of halogen and hydrogen bonds. (2015) (50)
- Non-linear hydrogen bonds and rotational spectroscopy: measurement and rationalisation of the deviation from linearity (1994) (50)
- Iodine and chlorine nuclear quadrupole coupling in the rotational spectra of Ar⋯ICl and ICl: intramolecular charge transfer induced in ICl by Ar (1999) (49)
- Pre-reactive complexes in mixtures of water vapour with halogens: characterisation of H2O...ClF and H2O...F2 by a combination of rotational spectroscopy and ab initio calculations. (2001) (48)
- Non-reactive interaction of ammonia and molecular chlorine: rotational spectrum of the ‘charge-transfer’ complex H3N⋯Cl2 (1994) (47)
- Donor–acceptor complexes of Lewis bases with bromine monochloride in the gas phase. Some generalisations from rotational spectroscopy (1995) (45)
- The rotational spectrum, chlorine nuclear quadrupole coupling constants, and molecular geometry of a hydrogen-bonded dimer of cyclopropane and hydrogen chloride (1982) (44)
- Can the nonlinearity of hydrogen bonds B…HX be measured precisely? A method from rotational spectroscopy and its application to 2,5-dihydrofuran…HCl (1994) (44)
- Geometry and nature of the binding of the pre-reactive complex C2H4…ClF from its rotational spectrum (1996) (42)
- Characterisation of a pre-reactive intermediate in gas-phase mixtures of fluorine and ammonia: the rotational spectrum of the H3N…F2 complex (1995) (41)
- Microwave rotational spectrum of a weakly bound complex formed by hydrogen sulphide and hydrogen chloride (1984) (41)
- Is the gas-phase complex of ammonia and chlorine monofluoride H3N…ClF or [H3NCl]+…F−? Evidence from rotational spectroscopy (1996) (41)
- Isolation of stable intermediates in reactive gas mixtures: Rotational spectrum of H3P...Cl2 in a pulsed jet (1993) (40)
- The nature of the hydrogen bond to water in the gas phase (1992) (40)
- 83Kr nuclear quadrupole coupling, microwave spectrum, and structure of KrHCN (1983) (40)
- Experimental determination of the dissociation energies D0 and De of H2O…HF (1987) (39)
- Characterisation of the Intermediate C2H4…︁Cl2 in a Gaseous Mixture of Ethene and Chlorine by Rotational Spectroscopy: A Weak π‐Type Complex (1995) (39)
- Properties of the intermediate ethyne…Cl2 from its rotational spectrum and some generalisations for a series B…Cl2 (1994) (38)
- An investigation of the trimethylammonium chloride molecule in the vapor phase by pulsed‐nozzle, Fourier‐transform microwave spectroscopy (1989) (38)
- Infrared diode‐laser spectroscopy and Fourier‐transform microwave spectroscopy of the (CO2,CO) dimer in a pulsed jet (1989) (38)
- Nature of complexes B … ClF in the gas phase: Conclusions from systematic variation of the Lewis base B and a comparison of the B … ClF/B … HCl series. (1997) (38)
- What's in a name? 'Coinage-metal' non-covalent bonds and their definition. (2018) (38)
- The rotational spectrum and molecular properties of the hydrogen cyanide hydrogen bromide complex (1983) (38)
- A reduced radial potential energy function for the halogen bond and the hydrogen bond in complexes B···XY and B···HX, where X and Y are halogen atoms. (2014) (37)
- The complex OC 3. C1F identified as a pre-chemical intermediate by rotational spectroscopy of carbon monoxide-chlorine monofluoride mixtures (1995) (37)
- Microwave spectrum and structure of nitrosyl fluoride (1969) (36)
- Rotational spectrum of thiophene···HCl Does thiophene act as an aromatic π-type electron donor or an n-type electron donor in hydrogen-bond formation? (1998) (36)
- The rotational spectrum and properties of N2 ⋅⋅⋅ HCN (1985) (36)
- Interaction of water and dichlorine in the gas phase: An investigation of H2O⋯Cl2 by rotational spectroscopy and ab initio calculations (2001) (36)
- Observation of c-type transitions and H, F nuclear spin—nuclear spin coupling in the rotational spectrum of (CH2)2O…HF (1991) (35)
- N2-Cu-F: a complex of dinitrogen and cuprous fluoride characterized by rotational spectroscopy. (2006) (35)
- Stark effects in the rotational spectrum of the dimer H2O⋅⋅⋅HF and the variation of the electric dipole moment with excitation of the low‐frequency, hydrogen‐bond modes (1983) (35)
- The rotational spectrum and nature of the heterodimer in trimethylammonium bromide vapor (1990) (35)
- Non-linearity of weak B⋯H–C hydrogen bonds: an investigation of a complex of vinyl fluoride and ethyne by rotational spectroscopy (2003) (34)
- Dipole moment enhancement on formation of a hydrogen-bonded complex. Demonstration and measurement of the effect for HCN…HF by microwave spectroscopy (1976) (34)
- Proton transfer in amine-hydrogen halide complexes: comparison of low temperature matrices with the gas phase (1998) (34)
- The rotational spectrum of the weakly bound molecular complex OC ··· HCN investigated by pulsed-nozzle, Fourier-transform microwave spectroscopy (1984) (34)
- D-nuclear quadrupole and H(D),19F nuclear-spin—nuclear-spin hyperfine coupling constants from rotational spectra of H2O…DF and H2O…HF (1982) (34)
- The rotational spectrum and structure of the phosphine-hydrogen cyanide complex (1984) (34)
- Monohydrates of cuprous chloride and argentous chloride: H2O⋅⋅⋅CuCl and H2O⋅⋅⋅AgCl characterized by rotational spectroscopy and ab initio calculations. (2011) (34)
- Nuclear quadrupole coupling constant in dinitrogen: a determination from the rotational spectrum of N2...HCCH (1991) (33)
- Is pyridinium hydrochloride a simple hydrogen-bonded complex C5H5N···HCl or an ion pair C5H5NH+···Cl- in the gas phase? An answer from its rotational spectrum (1998) (33)
- An Ab Initio Investigation of the Geometries and Binding Strengths of Tetrel-, Pnictogen-, and Chalcogen-Bonded Complexes of CO2, N2O, and CS2 with Simple Lewis Bases: Some Generalizations (2018) (33)
- Angular and radial geometries, charge transfer and binding strength in isolated complexes B⋯ICl: some generalisations (1999) (33)
- Nonreactive Interactions between Ethene and Halogens: Detection of a π‐Donor Complex C2H4BrCl by Rotational Spectroscopy (1994) (32)
- The structure and ground state dynamics of Ar–IH (1999) (32)
- The interaction of water and dibromine in the gas phase: an investigation of the complex H(2)O...Br(2) by rotational spectroscopy and ab initio calculations. (2002) (32)
- Rotational spectrum of the gas-phase dimer OC⋯BrCl (1994) (32)
- Characterisation of H2S···CuCl and H2S···AgCl isolated in the gas phase: a rigidly pyramidal geometry at sulphur revealed by rotational spectroscopy and ab initio calculations. (2011) (32)
- Cyclopropane-hydrogen chloride dimer: identification and geometry from its rotational spectrum (1980) (32)
- Rotational spectrum of a weakly bound dimer of formaldehyde and acetylene: Identification and characterization of a bridged planar form involving two nonlinear hydrogen bonds (1988) (31)
- Anisotropic repulsion in complexes B.Cl2 and B.HCl: The shape of the chlorine atom-in-a-molecule (1995) (31)
- Existence and molecular properties of a gas-phase, hydrogen-bonded complex between hydrogen fluoride and water established from microwave spectroscopy (1975) (31)
- Characterisation by rotational spectroscopy of a hydrogen-bonded dimer formed between H2O and HCN (1983) (31)
- An investigation of the rotational spectrum of H2S...HF by pulsed -nozzle Fourier-transform microwave spectroscopy: determination of the hyperfine coupling constants. (1984) (30)
- Rotational spectroscopy of 15N-hydrogen cyanide dimer: Detection, relative stability and D-nuclear quadrupole coupling of deuterated species (1983) (30)
- Identification and characterisation of the gas-phase complex HCN⋯Cl2 by rotational spectroscopy (1993) (30)
- Detection and Characterization of a Pre‐Reactive Complex in a Mixture of Water and Fluorine: Rotational Spectrum of H2O…︁F2 (1997) (29)
- Rotational spectroscopy of a weak complex of thiirane and ethyne: The identification and properties of a highly nonlinear S⋯H–C hydrogen bond (2003) (29)
- The angular geometry of thiirane ⋯ HF and the nonlinearity of the hydrogen bond from rotational spectroscopy (1994) (29)
- The rotational spectrum and molecular geometry of an antihydrogen‐bonded dimer of sulfur dioxide and hydrogen cyanide (1986) (29)
- Electric-charge redistribution in the HCl subunit of hydrogen-bonded dimers B • • • HC1 from Cl nuclear quadrupole coupling: determination of the coefficient Fzz of the electric-field-induced field gradient in HCl (1988) (28)
- A characterisation of the complex vinyl fluoride hydrogen fluoride by rotational spectroscopy and ab initio calculations (2004) (28)
- Do methyl groups form hydrogen bonds? An answer from the rotational spectrum of ethane—hydrogen cyanide (1992) (28)
- Pre-chemical interactions in a pulsed jet: the angular geometry of thiirane ⋯ HCl and the nonlinearity of its hydrogen bond from rotational spectroscopy (1995) (28)
- Rotational spectroscopy of a pre-reactive mixture of H2S and F2: detection and characterisation of the weakly bound complex H2S…F2 (1997) (28)
- The complex H3N⋅⋅⋅Br2 characterized in the gas phase by rotational spectroscopy (1995) (27)
- H2S⋯Cl2 characterised in a pre-reactive gas mixture of hydrogen sulfide and chlorine through rotational spectroscopy: the nature of the interaction (1995) (27)
- Rotational spectrum and properties of the hydrogen-bonded heterodimer H2O· · · HCN from pulsed-nozzle, Fourier-transform microwave spectroscopy (1984) (27)
- OCCuI synthesized by reaction of laser-ablated Cu with a CH3I/CO/Ar mixture and characterised by pulsed-jet, Fourier-transform microwave spectroscopy (2006) (27)
- ‘Charge-transfer’ complexes of ammonia with halogens. Nature of the binding in H3N⋯BrCl from its rotational spectrum (1995) (27)
- A method for the determination of the dissociation energies D0 and De for hydrogen-bonded dimers from the intensities of rotational transitions and its application to HCN…HF (1978) (27)
- A π-electron donor–acceptor complex of ethene and iodine monochloride: geometry, binding strength and charge redistribution determined by rotational spectroscopy (1999) (27)
- Methane as a proton acceptor: rotational spectrum and internal dynamics of a weakly bound dimer of methane and hydrogen cyanide (1992) (27)
- Halogen Bonding with Phosphine: Evidence for Mulliken Inner Complexes and the Importance of Relaxation Energy. (2016) (27)
- Rotational spectrum, H, 19F spin–spin and D–nuclear quadrupole coupling constants, and molecular geometry of the sulphur dioxide–hydrogen fluoride dimer (1986) (26)
- Evidence for a pre-reactive intermediate in a gaseous mixture of ethyne and chlorine monofluoride. Rotational spectrum of the Mulliken bπ· aσ complex C2H2⋯ClF (1996) (26)
- Molecular geometry of OC···AgI determined by broadband rotational spectroscopy and ab initio calculations. (2012) (26)
- Rotational spectrum of the trimethylamine‐hydrogen iodide dimer: An ion pair (CH3)3NH+⋅⋅⋅I− in the gas phase (1993) (26)
- Spectroscopic investigations of hydrogen bonding interactions in the gas phase. IX. Vibrational satellites in the rotational spectrum of the hydrogen-bonded homodimer HCN • • • HCN (1985) (26)
- Comparisons of the interactions of benzene, furan and thiophene with Lewis acids: the rotational spectrum of thiophene⋯HF (1998) (26)
- The geometries of the heterodimers SO2...HF and SO2...HCl as determined by rotational spectroscopy (1986) (26)
- Rotational spectrum and structure of a hydrogen-bonded dimer of phosphine with hydrogen bromide (1983) (25)
- HFI and DFT study of the bonding in complexes of halogen and interhalogen diatomics with Lewis base (2006) (25)
- Distortion of ethyne on formation of a π complex with silver chloride: C2H2⋯Ag-Cl characterised by rotational spectroscopy and ab initio calculations. (2012) (25)
- Nonlinear hydrogen bonds O ⋯ HC and the rôle of secondary interactions. The rotational spectrum of the oxirane ⋯ acetylene complex (1995) (25)
- The rotational spectrum of the benzene-hydrogen bromide complex (1997) (25)
- Rotational spectrum of thiophene⋯ClF and the role of thiophene as a π- or n-electron pair donor in weakly bound complexes (1998) (25)
- Changes in the geometries of C₂H₂ and C₂H₄ on coordination to CuCl revealed by broadband rotational spectroscopy and ab-initio calculations. (2014) (25)
- Nucleophilicities of Lewis Bases B and Electrophilicities of Lewis Acids A Determined from the Dissociation Energies of Complexes B⋯A Involving Hydrogen Bonds, Tetrel Bonds, Pnictogen Bonds, Chalcogen Bonds and Halogen Bonds (2017) (25)
- Rotational spectroscopy of the gas phase complex of water and bromine monochloride in the microwave region: Geometry, binding strength and charge transfer (2001) (25)
- H3N⋯Ag–Cl: Synthesis in a supersonic jet and characterisation by rotational spectroscopy (2010) (24)
- Inter- and intramolecular electron transfer in the complex OC···ICl determined from iodine and chlorine nuclear quadrupole hyperfine structure in its rotational spectrum (1999) (24)
- Evidence concerning the relative nucleophilicities of non-bonding and π-bonding electrons in furan from the rotational spectrum of furan···ClF (1998) (24)
- A prototype transition-metal olefin complex C2H4···AgCl synthesised by laser ablation and characterised by rotational spectroscopy and ab initio methods. (2011) (24)
- The identification of the classical donor–acceptor complex H3N–BF3 in the gas phase (1991) (23)
- Spectroscopic characterization of the hydrogen bonded OC-HI in supersonic jets (1993) (23)
- Angular geometry, binding strength and charge transfer for the complex H2S⋯ICl determined by rotational spectroscopy (1999) (23)
- Are B…ClF bonds linear? The angular geometry of a pre-reactive complex of oxirane and chlorine monofluoride from rotational spectroscopy (1996) (23)
- The rotational spectrum of the hydrogen-bonded heterodimer H2O…HF in the frequency range 40–80 GHz (1985) (23)
- Rotational spectra and properties of complexes B···ICF3 (B = Kr or CO) and a comparison of the efficacy of ICl and ICF3 as iodine donors in halogen bond formation. (2011) (23)
- Angular geometries of complexes containing the O⋯Cl–F linkage: Rotational spectrum of formaldehyde⋯chlorine monofluoride (1998) (23)
- Dissociation energies of the hydrogen‐bonded dimers RCN⋅⋅⋅HF (R=CH3, HCC) determined by rotational spectroscopy (1987) (22)
- Mulliken inner complexes [(CH3)3 NCl]+...F− in pre-reactive mixtures of trimethylamine and chlorine monofluoride: identification and characterisation by rotational spectroscopy (1996) (22)
- Microwave spectrum, structure, dipole moment, and deuterium nuclear quadrupole coupling constants of the acetylene–sulfur dioxide van der Waals complex (1991) (22)
- Properties of the halogen-bonded complex H2S···Br2 established by rotational spectroscopy and ab initio calculations (2001) (22)
- Microwave spectrum and structure of the polar N2O dimer (2008) (22)
- The extent of proton transfer from X to N in the gas-phase dimers (CH3)3-nHnN...HX. Evidence from rotational spectroscopy (1989) (22)
- Experimental detection and properties of H2O...Ag-Cl and H2S...Ag-Cl by rotational spectroscopy. (2010) (22)
- Interaction of benzene and halogens in the gas-phase: rotational spectrum of C6H6···ClF (1998) (22)
- Rotational spectroscopy and the properties of hydrogen-bonded dimers B•••HA (1983) (22)
- The bπ.aσ complex C2H2⋯Cl2 characterised by rotational spectroscopy as an intermediate in a reactive mixture of ethyne and chlorine (1995) (22)
- A π-electron donor–acceptor complex C2H4···Br2 characterised by its rotational spectrum (2001) (22)
- Molecular geometries of H2S···ICF3 and H2O···ICF3 characterised by broadband rotational spectroscopy. (2011) (22)
- Structure and potential energy function of cyclopent-3-enone. Part 1.—Microwave spectrum, ring planarity, rs-structure, and dipole moment (1973) (21)
- Potential constants for the hydrogen-bonded dimer H2O⋯HF: Directional character of the hydrogen bond (1984) (21)
- Rotational spectroscopy of H3P⋯BrCl and the systematics of intermolecular electron transfer in the series B⋯BrCl, where B=CO, HCN, H2O, C2H2, C2H4, H2S, NH3, and PH3 (2000) (21)
- The pairwise interaction of methane with hydrogen cyanide: a surprising result from rotational spectroscopy (1989) (21)
- Rotational spectrum and properties of a gas-phase complex of molecular fluorine and hydrogen cyanide (1996) (21)
- The pairwise interaction of methane and hydrogen bromide: properties of the weakly bound dimer CH4…HBr from microwave spectroscopy (1992) (21)
- The pre-reactive complex H2O⋯ClF identified in mixtures of water vapour and chlorine monofluoride by rotational spectroscopy (1996) (21)
- Spectroscopic investigations of hydrogen bonding interactions in the gas phase: Part VI. A microwave spectroscopie determination of geometry for the heterodimer (CH2)3O⋯HF formed between oxetane and hydrogen fluoride: hydrogen bonding as a probe for lone pairs (1980) (21)
- Pulsed‐nozzle, Fourier‐transform microwave spectroscopy of the methyl cyanide–acetylene dimer (1986) (21)
- Investigation of the rotational spectrum of the hydrogen‐bonded dimer formed between methylenecyclopropane and HCl (1994) (21)
- An investigation of the gas-phase complex of water and iodine monochloride by microwave spectroscopy: geometry, binding strength and electron redistribution (2000) (21)
- Rotational spectrum of HCN…HI and a comparison of properties in the series HCN…HX (X=F, Cl, Br, I and CN) (1994) (21)
- The Pre-Reactive Complex of H2S and BrCl; Observation and Characterisation by Rotational Spectroscopy (1996) (20)
- The lengthening of the HF bond on formation of heterodimers B • • • HF: determination and dependence on the strength of the hydrogen bond (1986) (20)
- Rotational spectrum of the hydrogen-bonded heterodimer H2S⋯HBr (1986) (20)
- Br nuclear quadrupole and H,Br nuclear-spin―nuclear-spin coupling in the rotational spectrum of H2O...HBr (1988) (20)
- Are members of the family of hydrogen-bonded complexes formed by furan with the hydrogen halides isostructural? An answer from the rotational spectrum of furan⋯HBr (2002) (20)
- A non-linear hydrogen bond F⋯H–Br in vinyl fluoride ⋯HBr characterised by rotational spectroscopy (2002) (20)
- Geometry, strength of binding and Br2 charge redistribution in the complex OC ··· Br2 determined by rotational spectroscopy (1999) (20)
- Rotational spectrum and molecular properties of the dinitrogen–chlorine monofluoride complex (1996) (20)
- Internal dynamics of subunits and bending force constants in weakly bound dimers (1986) (20)
- Theoretical and experimental evidence for partial ionic character in the trimethylamine-hydrogen chloride dimer (1989) (19)
- H,19F Nuclear-spin-nuclear-spin coupling in the rotational spectrum of (CH3)315N...HF and the lengthening of the HF bond (1989) (19)
- Studies of Ar:HBr using fast scan submillimeter-wave and microwave coaxial pulsed jet spectrometers with sub-kHz precision (2003) (19)
- Secondary interactions in weakly bound complexes: A highly nonlinear hydrogen bond in thiirane·HCN established by rotational spectroscopy (1994) (19)
- Rotational Spectroscopy of Mixtures of Trimethylamine and Fluorine: Identification of the Ion Pair [(CH3)3NF]+ …︁ F− in the Gas Phase (1997) (19)
- A pseudo-π analogue of a Mulliken bπ.aσ typecomplex: The rotational spectrum of cyclopropane–chlorinemonofluoride (1997) (19)
- Non-reactive interaction of oxirane and hydrogen bromide: isolation of an oxirane–hydrogen bromide dimer in a supersonic jet and its characterisation by microwave spectroscopy (1990) (19)
- Geometric and electric properties of the donor–acceptor complex H3N–BF3 (1995) (19)
- Investigation of the rotational spectrum of the hydrogen-bonded dimer CF2CH2⋯HCl (1992) (19)
- Observation of the rotational spectra of CuI and AgI molecules generated by laser ablation in a pulsed-jet, Fourier-transform microwave spectrometer (2006) (19)
- The halogen bond between ethene and a simple perfluoroiodoalkane: C2H4⋯ICF3 identified by broadband rotational spectroscopy (2012) (18)
- Rotational spectroscopy of a mixture of thiirane and hydrogen bromide: detection and characterization of a short-lived complex (CH2)2SċHBr in a pulsed jet (1991) (18)
- Effect of weakening the hydrogen bond on the angular geometry of H2CO⋅⋅⋅HX: Evidence from the rotational spectrum of H2CO⋅⋅⋅HCN (1987) (18)
- 14N- and D-nuclear quadrupole coupling in the rotational spectrum of (CH3)314N…H(D)F: Modification of the electric field gradients at the N and D nuclei (1989) (18)
- Pulsed-jet, diode-laser IR spectroscopy of the ν=1→0 transition in the CO2 asymmetric stretching mode of (CO2, HCN) (1989) (18)
- Halogen nuclear quadrupole coupling in the rotational spectrum of H3N···ICl as a probe of inter- and intramolecular charge transfer (1999) (18)
- Is the carbon monoxide—acetylene dimer semirigid? Evidence from its rotational spectrum (1991) (18)
- Nonreactive interaction of methyl isocyanide and hydrogen chloride: isolation and characterization of CH3NC.cntdot..cntdot..cntdot.HCl in a pulsed jet (1992) (18)
- THE ROTATIONAL SPECTRUM, CHLORINE NUCLEAR QUADRUPOLE COUPLING CONSTANTS, AND MOLECULAR GEOMETRY OF A HYDROGEN‐BONDED DIMER OF CYCLOPROPANE AND HYDROGEN CHLORIDE (1982) (18)
- Determination of the axial component Fzz of the electric field-electric field gradient response tensor of hydrogen bromide (1988) (18)
- rs-Type coordinates in weakly-bound dimers: application to linear dimers B⋯HCN, where BCO, N2 and HCN (1988) (17)
- CMM-RS potential for characterization of the properties of the halogen-bonded OC-Cl2 complex, and a comparison with hydrogen-bonded OC-HCl. (2012) (17)
- Is ammonium iodide an ion pair H3N+ H⋯I– or a hydrogen-bonded species H3N⋯HI in the gas phase? (1992) (17)
- Prereactive Complexes of Dihalogens XY with Lewis Bases B in the Gas Phase: A Systematic Case for the Halogen Analogue B×××XY of the Hydrogen Bond B×××HX (1999) (17)
- A chalcogen-bonded complex H3N⋯S=C=S formed by ammonia and carbon disulfide characterised by chirped-pulse, broadband microwave spectroscopy. (2019) (17)
- H2S⋯Ag–I synthesized by a laser-ablation method and identified by its rotational spectrum (2012) (17)
- Monohydrate of argentous fluoride: H2O AgF characterised by rotational spectroscopy and ab initio calculations (2011) (17)
- Rotational spectrum, inversion spectrum and properties of the van der Waals molecule argon—oxirane (1986) (16)
- The vibrational state (100O) of Ar…HCl excited in a pulsed jet by a glow discharge. Rotational spectrum and lifetime (1992) (16)
- The rotational spectrum, 14N‐nuclear quadrupole coupling constants, and H,19F nuclear spin–nuclear spin coupling constant of the cyanogen–hydrogen fluoride dimer (1981) (16)
- Rotational spectroscopy of mixtures of ethyne and iodine monochloride: isolation and characterisation of the π-type complex C2H2···ICl (1999) (16)
- An investigation of hydrogen bonding between HCl and vinylacetylene: A molecule with two different π‐acceptor sites (1990) (16)
- NATURE AND ANGULAR GEOMETRY OF THE PRE-REACTIVE COMPLEX THIIRANE-CHLORINE MONOFLUORIDE FROM ITS ROTATIONAL SPECTRUM (1996) (16)
- The rotational constant A0 and planarity of the hydrogen-bonded complex H2CO⋯HCl (1996) (16)
- Rotational spectrum of phosphonium iodide vapour (1991) (15)
- Distortions of ethyne when complexed with a cuprous or argentous halide: the rotational spectrum of C2H2···CuF (2015) (15)
- Analysis of a coriolis interaction between the in-plane and out-of-plane hydrogen bond bending modes in the dimer of oxirane and hydrogen fluoride (1989) (15)
- The microwave spectrum and structure of t-butyl bromide; a comparison of CX bond distances in primary, secondary and tertiary monohalogenated hydrocarbons (1979) (15)
- A distributed electrostatic model for field gradients at nuclei in van der Waals molecules: application to complexes of HCl (1995) (15)
- Is there significant intermolecular charge transfer in the ground state of the HCN···ICI complex? An answer from rotational spectroscopy (1999) (15)
- Pre-reactive intermediates in gas-phase chemical reactions: a contribution from rotational spectroscopy (1996) (15)
- The rotational spectrum of the weakly bound dimer N2⋅⋅⋅HBr and the dynamics of the N2 and HBr subunits (1989) (15)
- Intermediates in the gas-phase reactions of acetylene and halogens: the identification of the acetylene–BrCl complex by rotational spectroscopy (1994) (15)
- The geometry and intermolecular binding of HCN…BrC1 probed by rotational spectroscopy (1995) (15)
- Pathways for inversion in the oxirane argon complex (2001) (14)
- The microwave spectrum, structure, and dipole moment of nitryl fluoride (1968) (14)
- Characterisation of the Weak Halogen Bond in N 2 ···ICF 3 by Pure Rotational Spectroscopy (2015) (14)
- Rotational spectrum of the hydrogen-bonded dimer acetonitrile.cntdot..cntdot..cntdot.hydrogen chloride (1987) (14)
- The microwave spectrum and ground-state structure of H2O⋯HI (1999) (14)
- Microwave spectra and structures of 1-cyano- and 1-iodo-adamantane (1972) (14)
- The rotational spectrum of the pyridine-hydrogen fluoride complex (1998) (13)
- 14N electric field gradient in trimethylamine complexes as a diagnostic for formation of ion pairs (1999) (13)
- Geometry of an Isolated Dimer of Imidazole Characterised by Rotational Spectroscopy and Ab Initio Calculations. (2016) (13)
- Non-Covalent Interactions Involving Alkaline-Earth Atoms and Lewis Bases B: An ab Initio Investigation of Beryllium and Magnesium Bonds, B···MR2 (M = Be or Mg, and R = H, F or CH3) (2019) (13)
- Hydrogen bonding in the gas phase. Infrared spectroscopic investigation of hydrogen fluoride alcohol–heterodimers (1979) (13)
- Quantitative gas-phase electrophilicities of the dihalogen molecules XY = F2, Cl2, Br2, BrCl and ClF (1998) (13)
- The microwave spectrum and geometry of the methanol—hydrogen chloride dimer (1984) (13)
- D-nuclear quadrupole coupling in the rotational spectrum of 15N2…DF and an interpretation of the hyperfine coupling constants χ aaD and DaaHF within a series of complexes B…HF (1984) (13)
- Molecular geometry of SO2…ClF from its rotational spectrum: a cis, planar complex with a linear O…ClF bond (1996) (13)
- A complex of molecular fluorine with an organic compound detected in the gas phase: the rotational spectrum of CH3CN … F2 (1996) (13)
- Internal dynamics and HF bond lengthening in the hydrogen-bonded heterodimer CH3CN⋯HF determined from nuclear hyperfine structure in its rotational spectrum (1986) (13)
- The rotational spectrum and angular geometry of a pre-reactive complex of allene and chlorine monofluoride (1997) (13)
- Geometry and binding strength of a π-type hydrogen-bonded complex of ethene and hydrogen bromide determined by rotational spectroscopy (2000) (12)
- Distortion of ethyne on coordination to silver acetylide, C2H2⋅⋅⋅AgCCH, characterised by broadband rotational spectroscopy and ab initio calculations. (2014) (12)
- Rotational spectrum and angular geometry of a pre-reactive complex of oxirane and F2 (1997) (12)
- Inter- and intramolecular electronic transfer on formation of H3P···ICl as determined by rotational spectroscopy (2000) (12)
- Detection and characterisation of a weakly bound dimer of allene and hydrogen fluoride by rotational spectroscopy (1988) (12)
- Microwave rotational spectrum and properties of a hydrogen-bonded dimer formed by trimethylamine and acetylene (1988) (12)
- Identification and geometry of dimers of phosphine and the hydrogen halides HCl and HBr from their rotational spectra detected by pulsed-nozzle, fourier-transform microwave spectroscopy (1982) (12)
- Conformations of hydrogen-bonded dimers formed by cyclic ethers with hydrogen fluoride: rotational spectrum of 2,5 dihydrofuran⋯HF (1987) (12)
- A monomeric complex of ammonia and cuprous chloride: H3N⋯CuCl isolated and characterised by rotational spectroscopy and ab initio calculations. (2015) (12)
- Geometries of H2S⋯MI (M = Cu, Ag, Au) complexes studied by rotational spectroscopy: The effect of the metal atom. (2016) (12)
- Configuration at oxygen and deviation of the O…ClF system from linearity in 2,5-dihydrofuran…ClF from rotational spectroscopy (1997) (12)
- Microwave spectrum, ring conformation and electric dipole moment of cyclopent-2-enone (1979) (12)
- Microwave spectra, hyperfine splittings and average structures of 3,3,3-trifluoropropyne, CF3CCH and trifluoroacetonitrile, CF3CN (1993) (12)
- The electric dipole moment of the hydrogen-bonded heterodimer HCN⋯HF. An investigation of the conditions leading to inadequacy of the second- and fourth-order perturbation theories of the Stark effect for linear molecules (1978) (12)
- Conformations of some bicyclic monoterpenes based on bicyclo[3.1.0]hexane from their low-resolution microwave spectra (1978) (11)
- A complex Ar⋯Ag–I produced by laser ablation and characterised by rotational spectroscopy and ab initio calculations: Variation of properties along the series Ar⋯Ag–X (X= F, Cl, Br and I) (2017) (11)
- The rotational spectrum of the argon—thiirane van der Waals molecule (1992) (11)
- Hydrogen bonding between vinylacetylene and HF: the role of steric effects in the geometry of vinylacetylene…HX complexes (1991) (11)
- The rotational spectrum, geometry, and intermolecular force constant of the heterodimer of hydrogen cyanide and fluoroform (1986) (11)
- The rotational spectrum and geometry of the heterodimer oxirane ⋅ ⋅ ⋅ hydrogen cyanide in the vibrational ground state and the vβ(0)=1 state (1986) (11)
- Cl-nuclear quadrupole coupling in the microwave spectra of 1-chloroadamantane and t-butyl chloride (1989) (11)
- Identification and characterization of a gas-phase complex of methylenecyclopropane and chlorine monofluoride by rotational spectroscopy (1997) (11)
- An Isolated Complex of Ethyne and Gold Iodide Characterized by Broadband Rotational Spectroscopy and Ab initio Calculations. (2015) (11)
- Van der Waals stretching and bending force constants from the rotational spectrum of argon… 1,3,5-trioxane (1993) (11)
- Geometry of a weakly bound complex (H2S, HCN) determined from an investigation of its rotational spectrum (1984) (11)
- Characterization by Microwave Spectroscopy of a Transient Hydrogen‐Bonded Complex of Oxirane and Hydrogen Chloride Isolated in a Pulsed Jet (1990) (10)
- Gas phase complexes of H3NCuF and H3NCuI studied by rotational spectroscopy and ab initio calculations: the effect of X (X = F, Cl, Br, I) in OCCuX and H3NCuX. (2016) (10)
- Structural and electronic properties of the charge-transfer complex H3P...Br2 determined by Fourier transform microwave spectroscopy. (2000) (10)
- H3P···AgI: generation by laser-ablation and characterization by rotational spectroscopy and ab initio calculations (2016) (10)
- Rotational spectrum, inversion, and geometry of 2,5-dihydrofuran...ethyne and a generalization about Z...H-C hydrogen bonds. (2005) (10)
- Nuclear hyperfine coupling constants of aluminium monoiodide determined by Fourier-transform microwave spectroscopy (2006) (10)
- Strengths of non-covalent interactions in hydrogen-bonded complexes B⋯HX and halogen-bonded complexes B⋯XY (X, Y = F, Cl): an ab initio investigation (2018) (10)
- Microwave spectrum, molecular geometry, ring bending potential function, and electric dipole moment of bicyclo[3.1.0]hexan-3-one (1978) (10)
- Determination of oscillation amplitudes and force constants in hydrogen-bonded dimers from nuclear quadrupole hyperfine coupling constants (1987) (10)
- Fermi resonance perturbations between (νβ=n) and (νσ=1, νβ=n−2) states in the rotational spectrum of HCN…HF (1987) (9)
- Electric field gradients and Sternheimer-type properties of the BrCl molecule: correlated, relativistic, ab initio calculations and modelling of nuclear quadrupole coupling constants in complexes B ⋯ BrCl (1996) (9)
- Rotational spectrum of a weakly bound dimer of carbonyl sulphide and hydrogen chloride (1985) (9)
- Can the pre-equilibrium molecular complex in a reactive mixture of ethene and chlorine be characterised? : an answer from rotational spectroscopy (1994) (9)
- A two force-constant model for complexes B⋯M-X (B is a Lewis base and MX is any diatomic molecule): Intermolecular stretching force constants from centrifugal distortion constants D(J) or Δ(J). (2016) (9)
- Cl and D nuclear quadrupole coupling in the rotational spectrum of 15N2…DCl and the dynamics of the DCl subunit (1988) (9)
- Isolation and characterisation of the transient complex H3N ⋯ Cl2 in the gas phase (1994) (9)
- Thermodynamic properties of hydrogen-bonded dimers B⋯HF from spectroscopy: B = HCN, CH3CN, HC2CN, (CH3)3CCN and H2O (1991) (9)
- Molecular geometries and other properties of H2O⋯AgI and H3N⋯AgI as characterised by rotational spectroscopy and ab initio calculations. (2017) (9)
- Measurement of inter- and intramolecular charge transfer in the complex N 2 ⋯ICl from analysis of halogen nuclear quadrupole hyperfine structure in the rotational spectrum (2000) (9)
- The microwave spectrum and ring planarity of cyclopent-2-en-1-one (1969) (9)
- Intramolecular competition between n-pair and π-pair hydrogen bonding: Microwave spectrum and internal dynamics of the pyridine-acetylene hydrogen-bonded complex. (2015) (9)
- Electric charge redistribution in BrCl resulting from interaction with Ar: the rotational spectrum of the linear complex Ar⋯BrCl (2001) (9)
- Pre-reactive intermediates in mixtures of hydrocarbons with chlorine monofluoride: characterisation of ethyne ⋯ ClF and ethene ⋯ ClF by rotational spectroscopy (1995) (8)
- A Sternheimer-like response property of the bromine molecule: electric field dependence of the Br field gradient (1997) (8)
- Rotational spectrum of vinyl fluoride···ClF: Are the π-bonding or nonbonding electrons the most nucleophilic region of vinyl fluoride? (1999) (8)
- The hydrogen-bonded complex H3P···HCl investigated by a combination of rotational spectroscopy and ab initio SCF calculations (2000) (8)
- Inter- and intramolecular electron transfer on formation of 15N2⋯BrCl determined from halogen nuclear quadrupole coupling in the rotational spectrum (2002) (8)
- Rotational spectrum and properties of the hydrogen-bonded dimer CH3CN⋯HCN (1987) (8)
- The σ-hole interaction between sulfur hexafluoride and ammonia characterised by broadband rotational spectroscopy. (2015) (8)
- Microwave rotational spectrum, ring-puckering vibrations, ring conformation and electric dipole moment of γ-crotonolactone (1981) (8)
- Microwave spectrum of a gas-phase charge-transfer complex (1975) (8)
- A point-charge representation of nonbonding electron pairs: model derived from the ability of the hydrogen bond to act as a probe of electron density (1989) (8)
- 33S-nuclear quadrupole coupling in the rotational spectrum of the weakly bound dimer SCO … HF (1985) (8)
- Structure and potential energy function of cyclopent-3-enone. Part 2.—Out-of-plane ring modes from far infra-red, Raman and microwave spectra: ring bending potential function (1973) (8)
- Highly Unsaturated Platinum and Palladium Carbenes PtC3 and PdC3 Isolated and Characterized in the Gas Phase (2016) (8)
- The nature of the interaction of molecular fluorine and Lewis bases B from a comparison of the properties of B···F2 and B···HF (1998) (7)
- Identification and geometry of the pre-reactive complex buta-1,3-diene···ClF by rotational spectroscopy (1997) (7)
- Rotational spectrum of CH 3 CN⋯ClF and evidence for the +I effect of a CH 3 group on the ‘chlorine’ bond N⋯ClF (1999) (7)
- Microwave spectrum of tungsten pentafluoride chloride (1969) (7)
- Nitrogen-14 nuclear quadrupole coupling and hydrogen fluoride (fluorine-19) nuclear spin-nuclear spin coupling in the microwave rotational spectrum of the acetonitrile-hydrogen fluoride dimer (1981) (7)
- Nonlinear hydrogen bonds of the type (CH2)2Z···HY: The rotational spectrum of a complex of methylenecyclopropane and hydrogen bromide (1999) (7)
- The angle deformation force field for the hydrogen-bonded heterodimer CH3CN⋯HF determined with the aid of the centrifugal distortion constant DJK (1980) (7)
- Isolation and characterisation of some transient complexes of chemical interest using pulsed-nozzle, Fourier-transform microwave spectroscopy. (1992) (7)
- Ground-state rotational spectrum of t-butyl isocyanide and an rs geometry of its heavy-atom skeleton (1989) (7)
- Vibrational satellites in the J= 3 ← 2 rotational transitions of D2O⋯DF: confirmation of the form of the potential energy function for the out-of-plane bending mode (1985) (7)
- A re-investigation of the microwave spectrum of trimethylsilylcyanide (1982) (7)
- Rotational spectrum of the nitrogen trifluoride–chlorine monofluoride complex and the inductive effect of groups R=CH3, H, F on R3N/ClF interactions (1998) (7)
- Interaction of a pseudo-π C-C bond with cuprous and argentous chlorides: Cyclopropane⋯CuCl and cyclopropane⋯AgCl investigated by rotational spectroscopy and ab initio calculations. (2015) (7)
- Bridgehead distortion at the C1 position of 1-fluoroadamantane revealed by rotational spectroscopy and ab initio calculations (2002) (7)
- The rotational spectrum of thiophene⋯HBr and a comparison of the geometries of the complexes B⋯HX, where B is benzene, furan or thiophene and X is F, Cl or Br (2004) (7)
- The nature of the complex formed between pyridine and hydrogen bromide in the gas phase: an experimental approach using rotational spectroscopy. (2004) (7)
- The microwave spectra and ring configuration of γ-butyrolactone and γ-crotonolactone (1970) (6)
- Microwave spectrum, structure and internal rotation of the methylamine–hydrogen chloride dimer (1993) (6)
- The geometry and intermolecular stretching force constant of the dimer of carbonyl sulphide and hydrogen cyanide as determined by rotational spectroscopy (1987) (6)
- Observation and Properties of a Hydrogen Bond to Carbon in a Short-Lived, Gas-Phase Complex of Methyl Isocyanide and Hydrogen Fluoride† (1992) (6)
- A quantitative approach to the pseudo-π nature of cyclopropane (1987) (6)
- Vibrational predissociative lifetimes of (1000) Ar…HCl and (1000) Kr…HCl from time-of-flight measurements in a pulsed-nozzle, FT microwave spectrometer (1993) (6)
- Rotational spectra of tert-butyl bromide and iodide measured in the millimetre-wave region and by Fourier-transform techniques (1993) (6)
- Identification of the OC–IH isomer based on near-infrared diode laser spectroscopy (1999) (6)
- Tilts, bends, and twists of methylene groups in four-membered rings. Evidence from the microwave spectrum of trimethylene sulphoxide (1974) (6)
- Hydrogen bonding in gaseous mixtures. Microwave spectroscopic detection of simple complexes (1975) (6)
- ELECTRIC AND MAGNETIC PROPERTIES OF THE BRCL MOLECULE (1995) (6)
- Nuclear hyperfine coupling constants of indium monoiodide determined by Fourier-transform, microwave spectroscopy (2006) (6)
- First-order stark effect and electric dipole moment of H3P … HC15N by pulsed-nozzle fourier-transform microwave spectroscopy (1984) (6)
- Halogen bonding in the gas phase: a comparison of the iodine bond in B⋯ICl and B⋯ICF3 for simple Lewis Bases B. (2015) (6)
- Bending force constants for weakly bound dimers AB (A = symmetric top, B = linear molecule) from centrifugal distortion in rotational spectra (1995) (6)
- Rotational spectrum of CH3NC...HCCH and a comparison of the properties of hydrogen bonds NC...HC and CN...HC (1992) (6)
- Pure rotational spectrum of Kr...HCl in the excited state (1000) observed with a glow‐discharge source in a pulsed‐nozzle Fourier‐transform microwave spectrometer (1993) (6)
- A gas phase complex of acetylene and bromine: geometry, binding strength and charge transfer from rotational spectroscopy (2001) (6)
- Fourier transform rotational spectrum and molecular structure of vinylcyclopropane (1996) (6)
- Computational approaches and sigma-hole interactions: general discussion. (2017) (6)
- Microwave spectrum of tellurium pentafluoride chloride (1973) (6)
- The rotational spectrum of the complex 2,5-dihydrofuran···HBr and the non-linearity of the O···HνBr hydrogen bond (1997) (6)
- Rotational spectrum of the trimethylphosphine–hydrogen fluoride complex (1998) (5)
- The microwave spectrum and molecular structure of trimethylene sulphoxide; bends, tilts and twists in the methylene groups (1977) (5)
- An Assessment of Radial Potential Functions for the Halogen Bond: Pseudo-Diatomic Models for Axially Symmetric Complexes B⋅⋅⋅ClF (B=N2 , CO, PH3 , HCN, and NH3 ). (2021) (5)
- NUCLEAR QUADRUPOLE COUPLING CONSTANTS IN COMPLEXES B...X2 : STERNHEIMER-TYPE PROPERTIES OF FREE X2 FROM EXPERIMENTAL INTRAMOLECULAR CHARGE SHIFTS (1996) (5)
- The rotational spectrum and structure of the hydrogen-bonded dimer formed between methylenecyclopropane and HF (1995) (5)
- Ground-state rotational spectrum of CH3NC⋯HCN and the nature of hydrogen bonds involving triply-bonded carbon (1992) (5)
- Spectroscopic investigations of hydrogen bonding interactions in the gas phase. VIII. Microwave rotational spectrum of the heterodimer H—C≡C—C≡N ∙ ∙ ∙ HF (1984) (5)
- Evalution of coriolis coupling constants for HCN...HF and their use in the estimation of vβ (1986) (5)
- Erratum: Spectroscopic Investigations of Hydrogen Bonding Interactions in the Gas Phase. X. Properties of the Hydrogen-Bonded Heterodimer HCN$\cdots$HF Determined from Hyperfine Coupling and Centrifugal Distortion Effects in Its Ground-State Rotational Spectrum (1986) (5)
- An investigation of the molecular geometry and electronic structure of nitryl chloride by a combination of rotational spectroscopy and ab initio calculations. (2008) (5)
- Does the vapour of trimethylphosphonium bromide contain ion pairs (CH3)3PH+⋯ Br– ? An answer from the rotational spectrum (1993) (5)
- Rotational spectroscopy and the nature of the trimethylammonium chloride molecule in the vapour phase: hydrogen-bonded dimer or ion pair? (1988) (5)
- SO3 complexes with nitrogen containing ligands as the object of nuclear quadrupole interactions and density functional theory calculations (2006) (4)
- Cooperative hydrogen bonds form a pseudocycle stabilizing an isolated complex of isocyanic acid with urea. (2017) (4)
- Faraday communications. Microwave spectroscopy of pyrolytically produced, rapidly isolated transient molecules (1991) (4)
- Non-Covalent Interactions Involving Alkaline-Earth Atoms and Lewis Bases B: An ab Initio Investigation of Beryllium and Magnesium Bonds, B ··· MR 2 (M = Be or Mg, and R = H, F or CH 3 ) (2019) (4)
- BENDING FORCE CONSTANTS FOR WEAKLY BOUND DIMERS AB (A, SYMMETRIC TOP; B, LINEAR MOLECULE) FROM GAS-PHASE NUCLEAR QUADRUPOLE COUPLING CONSTANTS (1996) (4)
- Chemistry in Laser-Induced Plasmas: Formation of M–C≡C–Cl (M = Ag or Cu) and their Characterization by Rotational Spectroscopy (2015) (4)
- Nitrogen-14 quadrupole coupling constants in N2O3 by isotopic labelling (1986) (4)
- MICROWAVE SPECTRUM AND GEOMETRY OF THE METHYL ISOCYANIDE-ARGON COMPLEX (1997) (4)
- The microwave spectrum and planarity of cyclopent-3-enone (1971) (4)
- Microwave spectra and structures of some 1-halogenoadamantanes (1968) (3)
- How do the nucleophilicity and size of an isocyano carbon atom differ from those of a cyano nitrogen atom (1992) (3)
- Spectroscopiċ investigations of hydrogen bonding interactions in the gas phase. X. Properties of the hydrogen-bonded heterodimer HCN∙ ∙ ∙HF determined from hyperfine coupling and centrifugal distortion effects in its ground-state rotational spectrum (1985) (3)
- The rotational spectrum and properties of a complex of trimethyl phosphine and hydrogen cyanide (1984) (3)
- Br-nuclear quadrupole coupling in the rotational spectrum of 1-bromoadamantane (1991) (3)
- An ab initio investigation of alkali-metal non-covalent bonds BLiR and BNaR (R = F, H or CH3) formed with simple Lewis bases B: the relative inductive effects of F, H and CH3. (2020) (2)
- Systematic behaviour of electron redistribution on formation of halogen-bonded complexes BXY, as determined via XY halogen nuclear quadrupole coupling constants. (2019) (2)
- Properties of a complex of carbon dioxide and chlorine monofluoride from rotational spectroscopy: Identification of an extremely weak interaction (1997) (2)
- A simple electrostatic model for predicting the HF bond lengthening on formation of B⋯HF (1989) (2)
- Non-Covalent Interactions of the Lewis Acids Cu–X, Ag–X, and Au–X (X = F and Cl) with Nine Simple Lewis Bases B: A Systematic Investigation of Coinage–Metal Bonds by Ab Initio Calculations (2021) (2)
- Second Law of Thermodynamics (1973) (2)
- A chalcogen-bonded complex (CH3)3N⋯S C O characterised by rotational spectroscopy (2020) (2)
- Microwave rotational spectrum, electric dipole moment and geometry of 2-bicyclo[3.1.0] hexanone (1984) (2)
- Other Spectroscopic Sources of Molecular Properties: Intermolecular Complexes as Examples (2010) (2)
- Microwave spectrum, planarity, and dipole moment of cyclobutane-1,2-dione (1973) (2)
- 79Br-Nuclear quadrupole coupling in the rotational spectrum of HC15N⋯D79Br: determination of the H(D)Br oscillation amplitudes and force constant (1987) (2)
- Nuclear hyperfine coupling constants of nitryl bromide from rotational spectroscopy (2008) (2)
- Dispersion and polar flattening: noble gas–halogen complexes (2018) (2)
- Microwave spectrum, equilibrium ring conformation and electric dipole moment of cyclobutane-1,2-dione (1979) (2)
- Iodine nuclear quadrupole coupling in the rotational spectrum of 1-iodoadamantane and the ionic character of the CI bond (1993) (2)
- Molecular recognition involving small gas-phase molecules (1993) (1)
- Rotational Spectrum of a Weakly Bound Dimer of Formaldehyde and Acetylene: Identification and Characterization of a Bridged Planar Form Involving Two Nonlinear Hydrogen Bonds. (1988) (1)
- Triatomic model of hydrogen-bond stretching modes in hydrogen-bonded dimers B⋯HX (1989) (1)
- Isolation of a Halogen-Bonded Complex Formed between Methane and Chlorine Monofluoride and Characterisation by Rotational Spectroscopy and Ab Initio Calculations (2019) (1)
- π-Electron “Donor—Acceptor” Complexes B×××CIF and the Existence of the “Chlorine Bond”. (1999) (1)
- Infrared quantum cascade laser spectroscopy of low frequency vibrations of intermolecular complexes (2011) (1)
- The Electrophilicities of XCF3 and XCl (X=H, Cl, Br, I) and the Propensity of These Molecules To Form Hydrogen and Halogen Bonds with Lewis Bases: An Ab Initio Study. (2021) (1)
- Electrostatic Potential and a Simple Extended Electric Dipole Model of Hydrogen Fluoride as Probes of Non-Bonding Electron Pairs in the Cyclic Ethers 2,5-Dihydrofuran, Oxetane and Oxirane (2017) (1)
- Pre-reactive complexes in mixtures of water vapour with halogens: Characterisation of H2O center dot center dot center dot ClF and H2O center dot center dot center dot F-2 by a combination of rotational spectroscopy and ab initio calculations (2001) (1)
- 33 S nuclear quadrupole coupling in the rotational spectra of (1000) and (0001) carbonyl sulfide: vibrational excitation in a D.C. glow discharge (1992) (1)
- The ground-state rotational spectrum and molecular geometry of ethynylstannane. (2006) (1)
- Radial Potential Energy Functions of Linear Halogen-Bonded Complexes YX···ClF (YX = FB, OC, SC, N2) and the Effects of Substituting X by Second-Row Analogues: Mulliken Inner and Outer Complexes (2022) (1)
- Pulsed-Nozzle, Fourier-Transform Microwave Spectroscopy of Hydrogen-Bonded Dimers (1987) (1)
- Nonbonding pairs in cyclic thioethers: Electrostatic modeling and ab initio calculations for complexes of 2,5‐dihydrothiophene, thietane, and thiirane with hydrogen fluoride (2018) (1)
- THE B-PI.A-SIGMA COMPLEX C2H2-CENTER-DOT-CENTER-DOT-CENTER-DOT-CL-2 CHARACTERIZED BY ROTATIONAL SPECTROSCOPY AS AN INTERMEDIATE IN A REACTIVE MIXTURE OF ETHYNE AND CHLORINE (1995) (1)
- Pulsed-nozzle Fourier-transform microwave spectrum of CH3HgCN: 14N and 201Hg quadrupole coupling (1988) (0)
- THE BROADBAND ROTATIONAL SPECTRUM AND GEOMETRY OF N$_{2}$$\cdots$ICF$_{3}$ (2013) (0)
- Nucleophilicity of the boron atom in compounds R-B, (R = F, Cl, Br, I, CN, NC, CH3, SiH3, CF3, H): a new look at the inductive effects of the group R. (2022) (0)
- Reduced nucleophilicities ИBof Lewis bases B: Is ИBindependent of whether B is involved in a hydrogen bond or a halogen bond? (2023) (0)
- ROTATIONAL SPECTROSCOPY OF PRE-REACTIVE MULLIKEN COMPLEXES OF HALOGENS WITH LEWIS BASES. (1996) (0)
- Microwave Spectra, Hyperfine Splittings and Average Structures of 3,3, 3‐Trifluoropropyne, CF3CCH and Trifluoroacetonitrile, CF3CN. (1993) (0)
- The rotational spectrum of H2S⋯HI and an investigation by ab initio calculations of the origins of the observed doubling of rotational transitions in both H2S⋯HI and H2S⋯F2. (2020) (0)
- Microwave Spectra and Structures of H_2O-AgCl and H_3N-AgCl. (2010) (0)
- UNEXPECTED GENERATION AND OBSERVATION OF A T-SHAPED COMPLEX OF H$_{2}$C$_{2}$$\cdots$AgCCH (2013) (0)
- THE ANGLE DEFORMATION FORCE FIELD FOR THE HYDROGEN-BONDED HETERODIMER CH3CN...HF DETERMINED WITH THE AID OF THE CENTRIFUGAL DISTORTION CONSTANT DJK (BERECHNUNGEN) (1981) (0)
- MICROWAVE SPECTRA AND STRUCTURES OF H$_{4}$C$_{2}$$\cdots$AgCl AND H$_{4}$C$_{2}$$\cdots$CuCl (2011) (0)
- THE ROTATIONAL SPECTRUM AND MOLECULAR PROPERTIES OF THE HYDROGEN CYANIDE-HYDROGEN BROMIDE COMPLEX (1983) (0)
- Corrigendum to: “Microwave spectrum and structure of the polar N2O dimer” [J. Mol. Spectrosc. 251 (2008) 153–158] (2013) (0)
- HYDROGEN BONDING IN THE GAS PHASE. INFRARED SPECTROSCOPIC INVESTIGATION OF HYDROGEN FLUORIDE ALCOHOL-HETERODIMERS (1979) (0)
- THE ACETYLENE-SULFUR DIOXIDE VAN DER WAALS COMPLEX (1990) (0)
- Comparisons of the interactions of benzene, furan and thiophene with Lewis acids: the rotational spectrum of thiophene center dot center dot center dot HF (1998) (0)
- Reduced nucleophilicity: an intrinsic property of the Lewis base atom interacting with H in hydrogen-bonds with Lewis acids HX (X = F, Cl, Br, I, CN, CCH, CP). (2022) (0)
- FORMATION OF COMPLEXES c-C3H6···MCl (M = Ag or Cu) AND THEIR CHARACTERIZATION BY BROADBAND ROTATIONAL SPECTROSCOPY (2015) (0)
- MICROWAVE SPECTRA AND STRUCTURES OF H$_2$S-CuCl AND H$_2$O-CuCl (2010) (0)
- Br‐Nuclear Quadrupole Coupling in the Rotational Spectrum of 1‐ Bromoadamantane. (1991) (0)
- Microwave Spectra And Geometries Of C2h2…aui And C2h4…aui (2014) (0)
- Microwave Spectrum and Geometry of H 3 P...AgI (2012) (0)
- Pure Rotational Spectrum and Molecular Geometry of an Isolated Complex of Imidazole and Urea (2016) (0)
- FORMATION OF M-C ≡ C-Cl (M = Ag or Cu) AND CHARACTERIZATION BY ROTATIONAL SPECTROSCOPY (2015) (0)
- Rotational spectrum of thiophene center dot center dot center dot ClF and the role of thiophene as a pi- or n-electron pair donor in weakly bound complexes (1998) (0)
- Rotational Spectra of tert‐Butyl Bromide and Iodide Measured in the Millimetre‐Wave Region and by Fourier‐Transform Techniques. (1993) (0)
- BROADBAND ROTATIONAL SPECTRUM AND MOLECULAR GEOMETRY OF OC $\cdots$AgI (2012) (0)
- Characterization by Microwave Spectroscopy of a Transient Hydrogen-Bonded Complex of Oxirane and HCl Isolated in a “Pulsed-Jet”. (1990) (0)
- MICROWAVE SPECTRA, MOLECULAR STRUCTURES AND INTERNAL DYNAMICS OF H$_{2}$S$\cdots$ICF$_{3}$ and H$_{2}$O$\cdots$ICF$_{3}$ REVEALED BY BROADBAND ROTATIONAL SPECTROSCOPY (2012) (0)
- The Microwave Spectrum of the C2H2…AgI Complex Assigned and Analysed using PGOPHER (2022) (0)
- Alkorta, I., & Legon, A. (2017). Nucleophilicities of Lewis Bases B and Electrophilicities of Lewis Acids A Determined from the Dissociation Energies of Complexes BA Involving Hydrogen Bonds, Tetrel Bonds, (2017) (0)
- MICROWAVE SPECTRUM AND STRUCTURE OF A POLAR DIMER OF N$_{2}$O (2008) (0)
- MICROWAVE SPECTRA AND STRUCTURES OF H$_2$O$\cdots$AgF (2011) (0)
- A reduced electrophilicity for simple Lewis acids A involved in non-covalent interactions with Lewis bases B. (2022) (0)
- MICROWAVE SPECTRUM AND GEOMETRY OF H$_{3}$P$\cdots$AgI (2012) (0)
- Internal Rotation in CF3ICdotsNH3 and CF3I\cdotsN(CH3)_3 Probed by Cp-Ftmw Spectroscopy (2011) (0)
- THE MICROWAVE ROTATIONAL SPECTRUM, MOLECULAR GEOMETRY, NITROGEN-14 NUCLEAR QUADRUPOLE COUPLING CONSTANTS, AND HYDROGEN, FLUORINE-19 NUCLEAR SPIN-NUCLEAR SPIN COUPLING CONSTANT OF THE NITROGEN-HYDROGEN FLUORIDE DIMER (1982) (0)
- A complex of molecular fluorine with an organic compound detected in the gas phase: The rotational spectrum of CH3CN center dot center dot center dot F-2 (1996) (0)
- Evidence From Broadband Rotational Spectroscopy For A Complex Between Agcch And C6h6 (2014) (0)
- DETERMINING THE TUNNELING PATH OF THE CHF$_3-$Ar COMPLEX (2006) (0)
- Data for: A chalcogen-bonded complex (CH3)3N...S=C=O characterised by rotational spectroscopy (2020) (0)
- GEOMETRY OF AN ISOLATED DIMER OF IMIDAZOLE CHARACTERISED BY ROTATIONAL SPECTROSCOPY AND AB INITIO CALCULATIONS (2016) (0)
- MICROWAVE SPECTRA OF Ar···AgI AND H2O···AgI PRODUCED BY LASER ABLATION (2017) (0)
- ROTATIONAL SPECTRA OF THE ACETYLENE-HCl AND ETHYLENE-HCl DIMERS (1981) (0)
- MICROWAVE SPECTRA AND STRUCTURES OF OC-AuI AND $^{15}$N$_{2}$-CuF (2006) (0)
- SPECTROSCOPIC INVESTIGATIONS OF HYDROGEN BONDING INTERACTIONS IN THE GAS PHASE. PART 6. A MICROWAVE SPECTROSCOPIC DETERMINATION OF GEOMETRY FOR THE HETERODIMER (CH2)3O...HF FORMED BETWEEN OXETANE AND HYDROGEN FLUORIDE: HYDROGEN BONDIN (1981) (0)
- Monohydrates of cuprous chloride and argentous chloride: H2O center dot center dot center dot CuCl and H2O center dot center dot center dot AgCl characterized by rotational spectroscopy and ab initio calculations (2011) (0)
- Microwave Spectra and Geometries of H 2 C 2 ...AgCl and H 2 C 2 ...CuCl (2012) (0)
- MICROWAVE SPECTRUM, STRUCTURE, AND INTERNAL DYNAMICS OF THE PYRIDINE - ACETYLENE WEAKLY BOUND COMPLEX (2014) (0)
- Gas phase complexes of H 3 (2016) (0)
- Detection and characterization of a pre-reactive complex in a mixture of water and fluorine: Rotational spectrum of H2O center dot center dot center dot F-2 (1997) (0)
- Nitrogen-14 quadrupole coupling in cyclopentadienylnickel nitrosyl by microwave spectroscopy (1988) (0)
- The Properties of Hydrogen‐Bonded Dimers from Rotational Spectroscopy (1991) (0)
- THE CHALCOGEN-BONDED COMPLEX H3N...S=C=S CHARACTERIZED BY CHIRPED-PULSE BROADBAND MICROWAVE SPECTROSCOPY (2019) (0)
- MICROWAVE SPECTRA AND STRUCTURE OF CF$_3$I$\cdots$CO (2011) (0)
- MICROWAVE ROTATIONAL SPECTRUM, ELECTRIC DIPOLE MOMENT AND GEOMETRY OF 2-BICYCLO(3.1.0)HEXANONE (1984) (0)
- Interaction of benzene and halogens in the gas-phase: rotational spectrum of C6H6 center dot center dot center dot ClF (1998) (0)
- CONFORMATIONS OF SOME BICYCLIC MONOTERPENES BASED ON BICYCLO(3.1.0)HEXANE FROM THEIR LOW-RESOLUTION MICROWAVE SPECTRA (1979) (0)
- INTERNAL ROTATION IN CF$_{3}$I$\cdots$NH$_{3}$ AND CF$_{3}$I$\cdots$N(CH$_{3})_3$ PROBED BY CP-FTMW SPECTROSCOPY (2011) (0)
- (CH3)3N···AgI AND H3N···AgI STUDIED BY BROADBAND ROTATIONAL SPECTROSCOPY AND AB INITIO CALCULATIONS (2015) (0)
- Correction to: The Hydrogen Bond, the Halogen Bond and Rotational Spectroscopy: A Personal Retrospective (2020) (0)
- The Hydrogen Bond, the Halogen Bond and Rotational Spectroscopy: A Personal Retrospective (2019) (0)
- Solid-state chemistry and applications: general discussion. (2017) (0)
- Is Ammonium Iodide an Ion Pair H3N+ H×××I- or a Hydrogen-Bonded Species H3N×××HI in the Gas Phase? (1992) (0)
- ROTATIONAL SPECTRA AND NUCLEAR QUADRUPOLE COUPLING CONSTANTS OF 4-HALOPYRAZOLES C3N2H3X (X = Br, I) (2017) (0)
- D.J. Millen (1988) (0)
- Ground-State Rotational Spectrum of tert.-Butyl Isocyanide and an rs Geometry of Its Heavy-Atom Skeleton. (1989) (0)
- Rotational spectrum of thiophene center dot center dot center dot HCl - Does thiophene act as an aromatic pi-type electron donor or an n-type electron donor in hydrogen-bond formation? (1998) (0)
- Is pyridinium hydrochloride a simple hydrogen-bonded complex C5H5N center dot center dot center dot HCl or an ion pair C5H5NH+center dot center dot center dot Cl- in the gas phase?: An answer from its rotational spectrum (1998) (0)
- INVESTIGATION OF RELATIVISTIC EFFECTS IN HYDROGEN BOND INTERACTIONS: OC--HI (1991) (0)
- THE BROADBAND ROTATIONAL SPECTRUM AND GEOMETRY OF N2 ICF3 (2013) (0)
- Microwave Spectra and Structures of H_2S-CuCl and H_2O-CuCl. (2010) (0)
- Sir Harold Walter Kroto. 7 October 1939 — 30 April 2016 (2017) (0)
- MICROWAVE SPECTROSCOPY AND STRUCTURE DETERMINATION OF H2S−MI (M=Cu,Ag,Au) (2016) (0)
- ROTATIONAL SPECTRA AND NUCLEAR QUADRUPOLE COUPLING CONSTANTS OF IODOIMIDAZOLES (2017) (0)
- Identification and geometry of the pre-reactive complex buta-1,3-diene center dot center dot center dot ClF by rotational spectroscopy (1997) (0)
- Halogen bonding vs hydrogen bonding in CHF2I complexes with NH3 and N(CH3)3 (2016) (0)
- Configuration at oxygen and deviation of the O center dot center dot center dot Cl-F system from linearity in 2,5-dihydrofuran center dot center dot center dot ClF from rotational spectroscopy (1997) (0)
- HALOGEN BONDS AND HYDROGEN BONDS IN THE GAS PHASE: SIMILARITY REVEALED THROUGH ROTATIONAL SPECTROSCOPY. (2009) (0)
- The pure rotational spectra of FCPtF and FptI (2016) (0)
- Angular geometries of complexes containing the O center dot center dot center dot Cl-F linkage: Rotational spectrum of formaldehyde center dot center dot center dot chlorine monofluoride (1998) (0)
- Highly Unsaturated Platinum and Palladium Carbenes PtC3 and PdC3 Isolated and Characterized in the Gas Phase (2016) (0)
- A test of ab initio-generated, radial intermolecular potential energy functions for five axially-symmetric, hydrogen-bonded complexes BHF, where B = N2, CO, PH3, HCN and NH3. (2021) (0)
- The rotational spectrum of the urea···isocyanic acid complex (2016) (0)
- INTERNAL DYNAMICS IN SF6···NH3 OBSERVED BY BROADBAND ROTATIONAL SPECTROSCOPY (2015) (0)
- MICROWAVE SPECTRA AND GEOMETRIES OF H$_{2}$C$_{2}$$\cdots$AgCl AND H$_{2}$C$_{2}$$\cdots$CuCl (2012) (0)
- Microwave Spectrum And Geometry Of Cf3i…ph3 (2014) (0)
- THE MICROWAVE SPECTRUM AND STRUCTURE OF TERT-BUTYL BROMIDE; A COMPARISON OF C-X BOND DISTANCES IN PRIMARY, SECONDARY AND TERTIARY MONOHALOGENATED HYDROCARBONS (1979) (0)
- The rotational spectrum of the complex 2,5-dihydrofuran center dot center dot center dot HBr and the non-linearity of the O center dot center dot center dot H-Br hydrogen bond (1997) (0)
- Teach spelling in context (2013) (0)
- Rotational spectroscopy of mixtures of trimethylamine and fluorine: Identification of the ion pair [(CH3)(3)NF](+)center dot center dot center dot F- the gas phase (1997) (0)
- A REINVESTIGATION OF THE MICROWAVE SPECTRUM OF TRIMETHYLSILYLCYANIDE (1982) (0)
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