Vibration assignment of carbon-sulfur bond in 2-thione-1,3-dithiole-4,5-dithiolate derivatives

被引:43
作者
Liu, GQ
Fang, Q [1 ]
Xu, W
Chen, HY
Wang, CL
机构
[1] Shandong Univ, State Key Lab Crystal Mat, Jinan 250100, Peoples R China
[2] Shandong Univ, Sch Phys & Microelement, Jinan 250100, Peoples R China
基金
中国国家自然科学基金;
关键词
2-thione-1,3-dithiole-4,5-dithiolate; carbon-sulfur bond; infrared and Raman spectra; fermi resonance; molecular orbital;
D O I
10.1016/S1386-1425(03)00260-9
中图分类号
O433 [光谱学];
学科分类号
0703 ; 070302 ;
摘要
The higher frequency peak near 1050 cm(-1) of the doublet in the infrared and Raman spectra of 2-thione-1,3-dithiole-4,5-di thiol ate (DMIT) derivatives corresponds mainly to the stretching vibration of carbon-sulfur double bond in the terminal S=CS2 fragments of DMIT skeletons while the lower one corresponds mainly to the Fermi resonance peak between overtones of symmetric stretching vibration of two carbon-sulfur single bond in the S=CS2 fragment of DMIT skeletons and the higher frequency. On the other hand, the higher frequency near 500 cm(-1) corresponds mainly to the symmetric stretching vibration of two carbon-sulfur single bond in the S=CS2 fragments of DMIT skeletons while the lower one corresponds mainly to the symmetric stretching vibration of the four carbon-sulfur single bond in the S2C=CS2 fragments of DMIT skeletons.
引用
收藏
页码:541 / 550
页数:10
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