EXPERIMENTAL AND QUANTUM-THEORETICAL INVESTIGATION OF THE CIRCULAR-DICHROISM SPECTRUM OF R-METHYLOXIRANE

被引：53
|
作者：
CARNELL, M [1 ]
PEYERIMHOFF, SD [1 ]
BREEST, A [1 ]
GODDERZ, KH [1 ]
OCHMANN, P [1 ]
HORMES, J [1 ]
机构：
[1] UNIV BONN,INST PHYS,W-5300 BONN,GERMANY
来源：
CHEMICAL PHYSICS LETTERS | 1991年 / 180卷 / 05期
关键词：
D O I：
10.1016/0009-2614(91)85153-N
中图分类号：
O64 [物理化学（理论化学）、化学物理学];
学科分类号：
070304 ; 081704 ;
摘要：
Methyloxirane, as a prototype for other substituted oxirane systems, was chosen for spectroscopic and theoretical study of circular dichroism. Vacuum UV absorption and CD spectra are reported, as well as ab initio multireference configuration interaction calculations for the rotatory strengths of the first three CD absorption bands. Good agreement between theory and experiment is obtained.
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页码：477 / 481
页数：5
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