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Conformational Analysis of 3-Metbylbutyronitrile

 

作者: G.A. Crowder,  

 

期刊: Spectroscopy Letters  （Taylor Available online 1988）
卷期: Volume 21, issue 6  

页码: 447-453

 

ISSN:0038-7010

 

年代: 1988

 

DOI:10.1080/00387018808062725

 

出版商: Taylor & Francis Group

 

关键词: 3-Methylbutyronitrile;Conformational analysis;Normal coordinate analysis;Vibrational spectra;Molecular mechanics calculations

 

数据来源: Taylor

 

摘要:

Infrared and Raman spectra were obtained for 3-methylbutyronitrile and were interpreted with the aid of normal coordinate calculations. The presence of both possible conformers was verified in this way. Molecular mechanics calculations were made for both conformers, and structural and energy data were obtained.

 

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