引用本文:
卢秀慧, 王沂轩, 邓从豪. 硅烯与乙烯环加成反应的理论研究[J]. 物理化学学报,
1998, 14(04): 332-336.
doi:
10.3866/PKU.WHXB19980409
Citation: Lu Xiu-Hui, Wang Yi-Xuan, Deng Cong-Hao. A Theoretical Study on the Cycloaddition Reaction of Silylene and Ethylene[J]. Acta Physico-Chimica Sinica, 1998, 14(04): 332-336. doi: 10.3866/PKU.WHXB19980409
Citation: Lu Xiu-Hui, Wang Yi-Xuan, Deng Cong-Hao. A Theoretical Study on the Cycloaddition Reaction of Silylene and Ethylene[J]. Acta Physico-Chimica Sinica, 1998, 14(04): 332-336. doi: 10.3866/PKU.WHXB19980409
硅烯与乙烯环加成反应的理论研究
English
A Theoretical Study on the Cycloaddition Reaction of Silylene and Ethylene
Abstract:
The cycloaddition reaction of silylene(SiH2, A) and ethylene has been studied by using ab initio calculations, a reasonable mechanism of the reaction has been suggested. The thermodynamic and kinetic properties of the reaction have been calculated by statistical thermo-dynamic method and transition-state theory(TST).
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