TRANSFERABILITY OF VALENCE FORCE-CONSTANTS - THE CASE OF NORMAL FATTY-ACID AMIDES

被引:5
作者
RAMULU, KS [1 ]
RAO, GR [1 ]
机构
[1] KAKATIYA UNIV COLL,DEPT PHYS,WARANGAL 506009,ANDHRA PRADESH,INDIA
关键词
D O I
10.1002/jrs.1250211108
中图分类号
O433 [光谱学];
学科分类号
0703 ; 070302 ;
摘要
A zero‐order calculation was made for n‐undecamide and of its N,N‐deuterated species by transferring the force constants from normal fatty acid amides. The observed and calculated frequencies agreed with an average error of 11 cm−1. Potential energy distributions and eigenvectors calculated in the process were utilized to make unambiguous vibrational assignments for the two molecules under investigation. Copyright © 1990 John Wiley & Sons, Ltd.
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收藏
页码:751 / 753
页数:3
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