Systematic behaviour of electron redistribution on formation of halogen-bonded complexes B⋯XY, as determinedviaXY halogen nuclear quadrupole coupling constants-Reference-Cited by-同舟云学术

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

Published:2019 Issue:31 Volume:21 Page:16914-16922
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Alkorta Ibon¹²³^ORCID,Legon Anthony C.⁴⁵⁶⁷^ORCID

Affiliation:

1. Instituto de Química Médica (IQM-CSIC)

2. E-28006 Madrid

3. Spain

4. School of Chemistry

5. University of Bristol

6. Bristol BS8 1TS

7. UK

Abstract

Systematic behaviour of the fractional electron redistributionδ_ifrom B to Br with ionisation energyI_Bon formation of B⋯BrY.

Funder

Ministry of Science, Innovation and Universities

Comunidad de Madrid

University of Bristol

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2019/CP/C9CP03463C

Reference28 articles.

1. Definition of the halogen bond (IUPAC Recommendations 2013)

2. The Halogen Bond

3. 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

4. Halogen bonding: the σ-hole

5. Halogen bonds and σ-holes

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