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Density Functional Study of Some Germylene Insertion Reactions

โœ Scribed by Su, Ming-Der; Chu, San-Yan


Book ID
121282693
Publisher
American Chemical Society
Year
1999
Tongue
English
Weight
161 KB
Volume
121
Category
Article
ISSN
0002-7863

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Theoretical studies of the insertions of
โœ Ming-Der Su; San-Yan Chu ๐Ÿ“‚ Article ๐Ÿ“… 1999 ๐Ÿ› Elsevier Science ๐ŸŒ French โš– 182 KB

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