𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Theoretical conformational analysis of seven-membered rings. V. MM2 and MM3 study of oxepane

✍ Scribed by A. Espinosa; M.A. Gallo; A. Entrena; J.A. Gómez


Book ID
107806904
Publisher
Elsevier Science
Year
1994
Tongue
English
Weight
902 KB
Volume
323
Category
Article
ISSN
0022-2860

No coin nor oath required. For personal study only.


📜 SIMILAR VOLUMES


A Theoretical Study of Anion–π Interacti
✍ David Quiñonero; Antonio Frontera; Daniel Escudero; Pablo Ballester; Antonio Cos 📂 Article 📅 2007 🏛 John Wiley and Sons 🌐 English ⚖ 410 KB

## Abstract Several complexes of tropylium (**1**) with anions are optimized at the RI‐MP2(full)/6‐31++G\*\* level of theory. This binding unit can interact very favorably with anions, and it combines the strength of the electrostatic interaction with the directionality of the anion–π interaction.

Molecular mechanics (MM) and MM-EHMO con
✍ Petko M. Ivanov; Tatyana G. Momchilova; Ivan G. Pojarlieff 📂 Article 📅 1991 🏛 John Wiley and Sons 🌐 English ⚖ 763 KB

The conformations of simple alkyl substituted 1 ,Bdiphenylethanes and the diastereoisomers of 3-amino-1,2,3triphenyl-1-propyl chloride were studied by the MM2 force field with the addition of electrostatic corrections to the aromatic force field as proposed recently by Allinger and Lii (dipole-dipol