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HMO theory and cyclophosphazenes

 

作者: N.L. Paddock,  

 

期刊: International Reviews in Physical Chemistry  (Taylor Available online 1986)
卷期: Volume 5, issue 2-3  

页码: 161-168

 

ISSN:0144-235X

 

年代: 1986

 

DOI:10.1080/01442358609353378

 

出版商: Taylor & Francis Group

 

数据来源: Taylor

 

摘要:

Hückel molecular orbital (HMO) theory is applied to (1) the bond lengths in phosphazenes arising from inhomogeneous substitution or complex formation, (2) conjugation between exocyclic groups and the ring and its consequences, and (3) chemical reactivity, carbanion stabilization and molecular rearrangements. Such bond characteristics as order, polarizability and electron localizability depend differently on relative orbital electronegativity. Ring size effects distinguish interactions of different symmetry types. Necessary theoretical improvements are briefly considered.

 

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