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The inductive effect in π-electron systems

 

作者: DenisR. Williams,  

 

期刊: Molecular Physics  (Taylor Available online 1967)
卷期: Volume 12, issue 1  

页码: 41-48

 

ISSN:0026-8976

 

年代: 1967

 

DOI:10.1080/00268976700100051

 

出版商: Taylor & Francis Group

 

数据来源: Taylor

 

摘要:

The shift ofn-π* bands of some azines on chloro substitution is examined assuming that the chloro substituent has only inductive character. This inductive character consists of both σ and π-electron interactions; the σ effect is approximated by the theory of Pople and Santry [7], whilst the π effect is assumed to have both short and long-range characteristics in the perturbing potential [1]. The calculations lead us to the conclusion that the approximations made in the estimation of σ effects are almost certainly responsible for the poor agreement observed between theory and experiment.

 

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