"Inductive" electronegativity scale: 2. 'Inductive' analog of chemical hardness

Citation
Ar. Cherkasov et al., "Inductive" electronegativity scale: 2. 'Inductive' analog of chemical hardness, J MOL ST-TH, 497, 2000, pp. 115-121
Citations number
13
Categorie Soggetti
Physical Chemistry/Chemical Physics
Journal title
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
ISSN journal
01661280 → ACNP
Volume
497
Year of publication
2000
Pages
115 - 121
Database
ISI
SICI code
0166-1280(20000201)497:<115:"ES2'A>2.0.ZU;2-O
Abstract
On the basis of a previously suggested approach to the calculation of "indu ctive" electronegativities of atoms and groups a simple method of theoretic al estimation of in situ inductive electronegativities is elaborated. The m ethod also allows the determination of inductive local and global chemical hardness parameters on the basis of geometric characteristics of bonded ato ms. This made it possible to provide a new "steric" interpretation for some known chemical rules, such as the principle of maximum hardness. (C) 2000 Elsevier Science B.V. All rights reserved.