CONFORMATIONAL-ANALYSIS OF TERPHENYLS BY PHOTOELECTRON-SPECTROSCOPY

被引:26
作者
KOBAYASHI, T [1 ]
机构
[1] UNIV TOKYO,INST SOLID STATE PHYS,MINATO KU,TOKYO 106,JAPAN
关键词
SPECTROSCOPY; ELECTRON;
D O I
10.1246/bcsj.56.3224
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
Vapor phase HeI photoelectron spectra of o- and m-terphenyl were measured, and conformational analysis of biphenyl, o-, m-, and p-terphenyl was made by comparing the observed photoelectron spectral patterns with the calculated ones by the CNDO/S method, the inter-ring twist angles in these compounds being estimated to be around 40 degree , 60 degree , 40 degree , and 40 degree , respectively. The results that the inter-ring twist angles in o-terphenyl are far smaller than 90 degree is completely in contrast to the long believed perpendicular model of o-terphenyl suggested by the gas electron diffraction study.
引用
收藏
页码:3224 / 3229
页数:6
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