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Definition of the chalcogen bond (IUPAC Recommendations 2019)

Pure and applied chemistry, 2019-11, Vol.91 (11), p.1889-1892

2019

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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

Molecules (Basel, Switzerland), 2018-09, Vol.23 (9), p.2250

2018

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Definition of the halogen bond (IUPAC Recommendations 2013)

Pure and applied chemistry, 2013-01, Vol.85 (8), p.1711-1713

2013

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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

Molecules (Basel, Switzerland), 2017-10, Vol.22 (10), p.1786

2017

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Tetrel, pnictogen and chalcogen bonds identified in the gas phase before they had names: a systematic look at non-covalent interactions

Physical chemistry chemical physics : PCCP, 2017-06, Vol.19 (23), p.14884-14896

Legon, Anthony C

2017

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Definition of the hydrogen bond (IUPAC Recommendations 2011)

Pure and applied chemistry, 2011-07, Vol.83 (8), p.1637-1641

2011

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Defining the hydrogen bond: An account (IUPAC Technical Report)

Pure and applied chemistry, 2011-07, Vol.83 (8), p.1619-1636

2011

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The halogen bond: an interim perspective

Physical chemistry chemical physics : PCCP, 2010-01, Vol.12 (28), p.7736-7747

Legon, Anthony C

2010

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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)

Inorganics, 2019-03, Vol.7 (3), p.35

2019

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Ab Initio Investigation of Tetrel Bonds in Isolated Complexes Formed Between a Lewis Acid H 3 MX, M-O or M-S (M = Si, Ge, or Sn) and the Lewis Bases B = N 2 , CO, HCCH, PH 3 , C 2 H 4 , HCN, CS, HNC, NP, H 2 O, and NH 3

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2024-07, Vol.128 (29), p.5963-5968

2024

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Ab Initio Investigation of Tetrel Bonds in Isolated Complexes Formed Between a Lewis Acid H3MX, M–O or M–S (M = Si, Ge, or Sn) and the Lewis Bases B = N2, CO, HCCH, PH3, C2H4, HCN, CS, HNC, NP, H2O, and NH3

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2024-07, Vol.128 (29), p.5963-5968

2024

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Isolation of a Halogen-Bonded Complex Formed between Methane and Chlorine Monofluoride and Characterisation by Rotational Spectroscopy and Ab Initio Calculations

Molecules (Basel, Switzerland), 2019-11, Vol.24 (23), p.4257

2019

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What's in a name? 'Coinage-metal' non-covalent bonds and their definition

Physical chemistry chemical physics : PCCP, 2018, Vol.20 (29), p.19332-19338

2018

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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)

ChemPlusChem (Weinheim, Germany), 2021-05, Vol.86 (5), p.731-740

Legon, Anthony C.

2021

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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

Physical chemistry chemical physics : PCCP, 2014-06, Vol.16 (24), p.12415-12421

Legon, Anthony C

2014

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Monohydrides of the Group 13 Elements M=B, Al and Ga: Axial Bi‐Nucleophilicity and the Propensity to Form Both H−M⋅⋅⋅HX and M−H⋅⋅⋅HX Hydrogen Bonds (X=F, Cl, Br, I, CN, CCH, CP)

ChemPlusChem (Weinheim, Germany), 2024-09, Vol.89 (9), p.e202400314-n/a

2024

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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

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2022-04, Vol.126 (16), p.2511-2521

2022

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Systematic behaviour of electron redistribution on formation of halogen-bonded complexes B⋯XY, as determined via XY halogen nuclear quadrupole coupling constants

Physical chemistry chemical physics : PCCP, 2019, Vol.21 (31), p.16914-16922

2019

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An ab initio investigation of alkali–metal non-covalent bonds B⋯LiR and B⋯NaR (R = F, H or CH3) formed with simple Lewis bases B: the relative inductive effects of F, H and CH3

Physical chemistry chemical physics : PCCP, 2020-01, Vol.22 (28), p.16421-16430

2020

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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

Crystals (Basel), 2017-09, Vol.7 (9), p.261

2017

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On the directionality and non-linearity of halogen and hydrogen bonds

Physical chemistry chemical physics : PCCP, 2015-01, Vol.17 (2), p.858-867

2015

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Halogen Bonding with Phosphine: Evidence for Mulliken Inner Complexes and the Importance of Relaxation Energy

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2016-10, Vol.120 (42), p.8461-8468

2016

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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

The Journal of chemical physics, 2020-11, Vol.153 (20), p.204301-204301

2020

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A chalcogen-bonded complex H3N⋯S=C=S formed by ammonia and carbon disulfide characterised by chirped-pulse, broadband microwave spectroscopy

The Journal of chemical physics, 2019-02, Vol.150 (8), p.084307-084307

2019

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Dispersion and polar flattening: noble gas–halogen complexes

Journal of molecular modeling, 2018-07, Vol.24 (7), p.172-6, Article 172

2018

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Definition of the chalcogen bond (IUPAC Recommendations 2019)

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

Definition of the halogen bond (IUPAC Recommendations 2013)

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

Tetrel, pnictogen and chalcogen bonds identified in the gas phase before they had names: a systematic look at non-covalent interactions

Definition of the hydrogen bond (IUPAC Recommendations 2011)

Defining the hydrogen bond: An account (IUPAC Technical Report)

The halogen bond: an interim perspective

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)

Ab Initio Investigation of Tetrel Bonds in Isolated Complexes Formed Between a Lewis Acid H 3 MX, M-O or M-S (M = Si, Ge, or Sn) and the Lewis Bases B = N 2 , CO, HCCH, PH 3 , C 2 H 4 , HCN, CS, HNC, NP, H 2 O, and NH 3

Ab Initio Investigation of Tetrel Bonds in Isolated Complexes Formed Between a Lewis Acid H3MX, M–O or M–S (M = Si, Ge, or Sn) and the Lewis Bases B = N2, CO, HCCH, PH3, C2H4, HCN, CS, HNC, NP, H2O, and NH3

Isolation of a Halogen-Bonded Complex Formed between Methane and Chlorine Monofluoride and Characterisation by Rotational Spectroscopy and Ab Initio Calculations

What's in a name? 'Coinage-metal' non-covalent bonds and their definition

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)

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

Monohydrides of the Group 13 Elements M=B, Al and Ga: Axial Bi‐Nucleophilicity and the Propensity to Form Both H−M⋅⋅⋅HX and M−H⋅⋅⋅HX Hydrogen Bonds (X=F, Cl, Br, I, CN, CCH, CP)

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

Systematic behaviour of electron redistribution on formation of halogen-bonded complexes B⋯XY, as determined via XY halogen nuclear quadrupole coupling constants

An ab initio investigation of alkali–metal non-covalent bonds B⋯LiR and B⋯NaR (R = F, H or CH3) formed with simple Lewis bases B: the relative inductive effects of F, H and CH3

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

On the directionality and non-linearity of halogen and hydrogen bonds

Halogen Bonding with Phosphine: Evidence for Mulliken Inner Complexes and the Importance of Relaxation Energy

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

A chalcogen-bonded complex H3N⋯S=C=S formed by ammonia and carbon disulfide characterised by chirped-pulse, broadband microwave spectroscopy

Dispersion and polar flattening: noble gas–halogen complexes

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