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Theoretical study on the selectivity of the insertion xenon atom into hypohalous acids

โœ Scribed by Ma, Lingling; Huang, Zhengguo; Niu, Xiqian; Zhang, Bohai; Wang, Qi


Book ID
122880413
Publisher
Elsevier Science
Year
2014
Tongue
English
Weight
310 KB
Volume
414
Category
Article
ISSN
0020-1693

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The reaction mechanism for the insertion of germylenes into the C-H bond of methane has been investigated using the B3LYP/6-311G\* level of theory. It is found that the more elecax3imsifive rod/or stronger x-accepting the substituents on the germylenes axe, the smaller the insertion barrier and the