Certain cyclophane-fused-azaindoline kind spirooxazines and their some isomers: an AM1 treatment


Tuurker L.

JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, vol.679, pp.17-24, 2004 (Journal Indexed in SCI) identifier identifier

  • Publication Type: Article / Article
  • Volume: 679
  • Publication Date: 2004
  • Doi Number: 10.1016/j.theochem.2004.03.024
  • Title of Journal : JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
  • Page Numbers: pp.17-24

Abstract

A certain set of spirooxazine structures possessing an azaindoline moiety as well as a cyclophane system have been considered such that the position of aza-nitrogen varied in each structure. Also their isomeric acyclic forms are considered. The AM I (RHF) type semiempirical quantum chemical treatment on these species has been performed. (C) 2004 Elsevier B.V. All rights reserved.