z-logo
Premium
Chemical Bonds without Bonding Electron Density — Does the Difference Electron‐Density Analysis Suffice for a Description of the Chemical Bond?
Author(s) -
Cremer Dieter,
Kraka Elfi
Publication year - 1984
Publication title -
angewandte chemie international edition in english
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 5.831
H-Index - 550
eISSN - 1521-3773
pISSN - 0570-0833
DOI - 10.1002/anie.198406271
Subject(s) - covalent bond , electron density , chemical bond , electron , bond , bond energy , electron localization function , atomic physics , chemistry , bent bond , sextuple bond , materials science , computational chemistry , molecular physics , bond order , crystallography , physics , bond length , molecule , quantum mechanics , organic chemistry , finance , economics , crystal structure
Formation of a covalent bond is not necessarily associated with an increase in electron density in the bonding region. This can be established by analysis of the single electron density distributions ρ( r ) with the aid of the assigned Laplace field ▽ 2 ρ( r ). For “bonds without bonding electron density ρ( r )”, it is decisive that the density ρ( r ) actually present in the region between the atoms results in a decrease in the local energy density and, hence, produces a stabilizing effect.

This content is not available in your region!

Continue researching here.

Having issues? You can contact us here
Accelerating Research

Address

John Eccles House
Robert Robinson Avenue,
Oxford Science Park, Oxford
OX4 4GP, United Kingdom