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Citation: Wang Gui-Chang, Pan Yin-Ming, Cai Zun-Sheng, Zhao Xue-Zhuang. Theoretical Study of the Reactivity of the Addition of Radicals to Fluoro-ethylenes[J]. Acta Physico-Chimica Sinica, ;1998, 14(02): 127-130. doi: 10.3866/PKU.WHXB19980206 shu

Theoretical Study of the Reactivity of the Addition of Radicals to Fluoro-ethylenes

1.
Chemistry Department of Nankai University,Tianjin 300071

Received Date: 23 April 1997
Available Online: 15 February 1997

In this paper the reactivity of radical -- molecular addition reaction is studied interms of AM1 semi- empirical method and the Lewis acid- base theory. The results suggest thatthe reactivity of such reactions is determined mainly by the perturbation energy between the tworeactants while the electrostatic energy between charges has only a small effect on it. In addition,it is found that there is a strong interaction between the two reaction center atoms.
- Addition reaction,
- Activation energy,
- AMl,
- Lewis acid-base theory
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