THEORETICAL-STUDY OF CYCLIC CONJUGATION IN PHENES - SOME HITHERTO UNNOTICED FEATURES

Citation
I. Gutman et V. Petrovic, THEORETICAL-STUDY OF CYCLIC CONJUGATION IN PHENES - SOME HITHERTO UNNOTICED FEATURES, Monatshefte fuer Chemie, 126(11), 1995, pp. 1179-1185
Citations number
34
Categorie Soggetti
Chemistry
Journal title
ISSN journal
00269247
Volume
126
Issue
11
Year of publication
1995
Pages
1179 - 1185
Database
ISI
SICI code
0026-9247(1995)126:11<1179:TOCCIP>2.0.ZU;2-9
Abstract
Cyclic conjugation in phenes is examined by means of the Bosanac-Gutma n-Aihara method. In contrast to the predictions based on the analysis of Kekule or Clar structures, we find that when going along the hexago ns of a phene molecule, cyclic conjugation varies in a rather non-unif orm manner. In contrast to a number of other homologous series of benz enoid hydrocarbons, the intensity of cyclic conjugation in phenes incr eases when going towards the center of the molecule.