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Charge-Shift Bonding: A New and Unique Form of Bonding.

Authors :
Shaik S
Danovich D
Galbraith JM
Braïda B
Wu W
Hiberty PC
Source :
Angewandte Chemie (International ed. in English) [Angew Chem Int Ed Engl] 2020 Jan 13; Vol. 59 (3), pp. 984-1001. Date of Electronic Publication: 2019 Nov 12.
Publication Year :
2020

Abstract

Charge-shift bonds (CSBs) constitute a new class of bonds different than covalent/polar-covalent and ionic bonds. Bonding in CSBs does not arise from either the covalent or the ionic structures of the bond, but rather from the resonance interaction between the structures. This Essay describes the reasons why the CSB family was overlooked by valence-bond pioneers and then demonstrates that the unique status of CSBs is not theory-dependent. Thus, valence bond (VB), molecular orbital (MO), and energy decomposition analysis (EDA), as well as a variety of electron density theories all show the distinction of CSBs vis-à-vis covalent and ionic bonds. Furthermore, the covalent-ionic resonance energy can be quantified from experiment, and hence has the same essential status as resonance energies of organic molecules, e.g., benzene. The Essay ends by arguing that CSBs are a distinct family of bonding, with a potential to bring about a Renaissance in the mental map of the chemical bond, and to contribute to productive chemical diversity.<br /> (© 2020 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim.)

Details

Language :
English
ISSN :
1521-3773
Volume :
59
Issue :
3
Database :
MEDLINE
Journal :
Angewandte Chemie (International ed. in English)
Publication Type :
Academic Journal
Accession number :
31476104
Full Text :
https://doi.org/10.1002/anie.201910085