Acta Chimica Sinica ›› 1990, Vol. 48 ›› Issue (10): 993-999. Previous Articles     Next Articles

Original Articles

呋喃和苯多烯醛分子中的共轭效应和共轭基干

虞忠衡;蒋明谦;戴萃辰;褚文华   

  1. 中国科学院化学研究所
  • 发布日期:1990-10-15

The conjugation and conjugated stem in furyl and phenyl-polyenal

YU ZHONGHENG;JIANG MINGQIAN;DAI CUICHEN;CHU WENHUA   

  • Published:1990-10-15

The results of CNDO/2 and PMO calculation of polyenals MeO(CH:CH)3CHO and RCH:CHCHO (R = furyl, Ph) indicate a distinction between conjugation and conjugated stem, i.e., the conjugation includes an overall change of mol. properties resulting from interaction among conjugated groups; the conjugated stem reflects only the effect of the interaction on the frontier MO's.

Key words: BENZENE, CONJUGATION, METHOXY GROUP, ALKENE P, CNDO APPROXIMATION, ALDEHYDES, MOLECULAR ORBITAL THEORY, PERTURBATION THEORY, FURAN

CLC Number: