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Ab initio study on the mechanism of forming a silapolycyclic compound between dimethylmethylenesilylene and acetone

✍ Scribed by Chunliang Tian; Haibin Yu; Xiuhui Lu


Book ID
108285843
Publisher
Elsevier Science
Year
2008
Tongue
English
Weight
309 KB
Volume
861
Category
Article
ISSN
0166-1280

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Ab initio Study of Mechanism of Forming
✍ Xiuhui Lu; Yuehua Xu; Zhenxia Lian; Yongqing Li πŸ“‚ Article πŸ“… 2010 πŸ› John Wiley and Sons 🌐 English βš– 245 KB πŸ‘ 1 views

## Abstract The mechanism of the cycloaddition reaction of forming a germanic hetero‐polycyclic compound between singlet germylidene (R1) and acetone (R2) has been investigated with CCSD(T)//MP2/6‐31G\* method. From the surface energy profile, it can be predicted that the dominant reaction pathway