CF3C(O)F水合作用的热力学和动力学理论研究

doi:10.3866/PKU.WHXB19960415

Acta Phys. -Chim. Sin. ›› 1996, Vol. 12 ›› Issue (04): 361-364.doi: 10.3866/PKU.WHXB19960415

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Thermodynamic and Kinetic Study of Gas-phase Hydrolysis of CF₃C(O)F to CF₃COOH

Sun Li-Peng,Ma Ao,Wang Yi-Xuan,Liu Cheng-Bu

College of Chemistry,Shandong University,Jinan 250100

Received:1995-07-11 Revised:1995-09-11 Published:1996-04-15
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Abstract

Abstract:

Based on the ab initio calculated results, the thermodynamic functions and kinetic parameters of the gas-phase hydrolysis of CF3C(O)F to CF3COOH have been calculated in the temperature range 200-1500 K with statistical thermodynamic method and Eyring’s transition state theory. The heat capacities of some important species ocurring in the reactions have been calculated and fitted in the formula (a + bT + cT2 + dT3 + eT4).

Key words: Thermodynamics, Kinetics, CF₃C(O)F, Gas-phase hydrolysis

Sun Li-Peng,Ma Ao,Wang Yi-Xuan,Liu Cheng-Bu. Thermodynamic and Kinetic Study of Gas-phase Hydrolysis of CF₃C(O)F to CF₃COOH[J]. Acta Phys. -Chim. Sin. 1996, 12(04), 361-364. doi: 10.3866/PKU.WHXB19960415

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Thermodynamic and Kinetic Study of Gas-phase Hydrolysis of CF₃C(O)F to CF₃COOH

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Thermodynamic and Kinetic Study of Gas-phase Hydrolysis of CF₃C(O)F to CF₃COOH