期刊论文详细信息
Croatica Chemica Acta
A Theoretical Study on Chlorobenzonitriles
Parusel, Andreas B. J.1  Köhler, Gottfried2  Schamschule, Rudolf2 
[1] NASA Ames Research Center, MS 239�?4, Moffett Field, CA 94035, USA;Institute for Theoretical Chemistry and Structural Biology, University of Vienna, Althanstrasse 14, 1090 Viena, Austria
关键词: chlorobenzonitriles;    radical addition;    reduction;    semiempirical study;   
DOI  :  
学科分类:化学(综合)
来源: Croatica Chemica Acta
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【 摘 要 】

The three isomers of chlorobenzonitrile (CBN) and the corresponding radical anions are investigated by semiempirical methods in order to Study the regioselectivity of solvated hydrogen and hydroxy radical attacks. Additional negative...

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