QUANTUM CHEMICAL STUDY ON THE MECHANISM OF THE ADDITION REACTION BETWEEN GERMYLENE AND EPOXYETHANE

The mechanism of addition reaction between germylene and epoxyethane has been investigated with B3LYP/6-311+G* method, geometry optimization, vibrational analysis and energy property for the involved stationary points on the potential energy surface have been calculated. From the surface energy prof...

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Auteurs principaux: TAN,XIAOJUN, PING,LI, WANG,WEIHUA, YANG,XIULI, ZHENG,GENGXIU
Langue:English
Publié: Sociedad Chilena de Química 2010
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Accès en ligne:http://www.scielo.cl/scielo.php?script=sci_arttext&pid=S0717-97072010000100018
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