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2007•Journal of Molecular Structure THEOCHEMRequires access

Ab initio study on the mechanism of forming a silapolycyclic compound between methylenesilylene and ethene

Xiuhui Lu, Xin Che, Haibin Yu, Pingping Xiang, Yuehua Xu

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Key concepts: Exothermic reaction, Cycloaddition, Singlet state, Chemistry, Ab initio, Potential energy surface, Energy profile, Reaction mechanism

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