Bulletin of the Chemical Society of Japan
Online ISSN : 1348-0634
Print ISSN : 0009-2673
ISSN-L : 0009-2673
The Photoelectron Spectra of Alcohols, Mercaptans and Amines
Hitoshi OgataHatsuki OnizukaYoshimasa NiheiHitoshi Kamada
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1973 Volume 46 Issue 10 Pages 3036-3040

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Abstract

The HeI photoelectron spectra of aliphatic amines, alcohols and mercaptans were measured. These spectra, especially those of methylsubstituted compounds, were interpreted in terms of the orbital energies and corresponding eigenvectors calculated by the CNDO/2 and the INDO type self-consistent field molecular orbital techniques. Modification of CNDO/2 was also performed and the results are briefly discussed.

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