Modeling of alkaline complexes of bicyclophosphoranic macrocycles and podants

Authors
Houalla, D Moureau, L Vidal, C
Citation
D. Houalla et al., Modeling of alkaline complexes of bicyclophosphoranic macrocycles and podants, PHOSPHOR SU, 156, 2000, pp. 81
Citations number
13
Categorie Soggetti
Inorganic & Nuclear Chemistry
Journal title
PHOSPHORUS SULFUR AND SILICON AND THE RELATED ELEMENTS
ISSN journal
10426507 → ACNP
Volume
156
Year of publication
2000
Database
ISI
SICI code
1042-6507(2000)156:<81:MOACOB>2.0.ZU;2-F
Abstract
The molecular modeling of 40 complexes issued from the complexation of Li+, Na+ and K+ by the phosphoranic macrocycles 1-7 and pedants 8-10 has been p erformed using the Insight II V97 program based on the ESFF force field inc luding the modules Builder, Discover 3 and Analysis.