Hu Rongzu, Song Jirong, Zhao Fangqi, Wang Bozhou, Gao Shengli, Zhu Chanhua, Chen Pei, Luo Yang, Ning Binke, Chen Sanping, Shi Qizhen. Kinetics of the Exothermic Decomposition Reaction of 3,7-Dinitroimino-2,4- diazabiscyclo[3,3,0]octane[J]. Chinese Journal of Chemical Physics , 2004, 17(6): 783-786. doi: 10.1088/1674-0068/17/6/783-786
Citation: Hu Rongzu, Song Jirong, Zhao Fangqi, Wang Bozhou, Gao Shengli, Zhu Chanhua, Chen Pei, Luo Yang, Ning Binke, Chen Sanping, Shi Qizhen. Kinetics of the Exothermic Decomposition Reaction of 3,7-Dinitroimino-2,4- diazabiscyclo[3,3,0]octane[J]. Chinese Journal of Chemical Physics , 2004, 17(6): 783-786. doi: 10.1088/1674-0068/17/6/783-786

Kinetics of the Exothermic Decomposition Reaction of 3,7-Dinitroimino-2,4- diazabiscyclo[3,3,0]octane

doi: 10.1088/1674-0068/17/6/783-786
Funds:  Project supported by the Science and Technology Foundation of Shanxi Key Laboratory of Physico-Inorganic Chemistry (29-3, 2001) and the Science and Technology Foundation of the National Defense Key Laboratory of Propellant and Explosive Combustion of Chin
  • Received Date: 2003-08-18
  • The kinetic parameters of the exothermic decomposition reaction of the title compound in a temperature-programmed mode have been studied by means of DSC. The DSC data obtained are fitted to the integral, differential and exothermic rate equations by linear least-squares, iterative, combined dichotomous and least-squares methods, respectively. After establishing the most probable general expression of differential and integral mechanism functions by the logical choice method, the corresponding values of the apparent activation energy (Ea), pre-exponential factor (A) and reaction order (n) will be obtained by the exothermic rate equation. The results show that the empirical kinetic model function in differential form and the values of Ea and A of this reaction are (1-α)0.44, 230.4 kJ/mol and 1018.16 s-1, respectively. With the help of the heating rate and obtained kinelic parameters, the kinetic equation of the exothermic decomposition reaction process of the title compound is proposed. The critical temperature of thermal explosion of the compound is 302.6℃. The above-mentioned kinetic parameters are quite useful for analyzing and evaluating the stability and thermal change rule of the title compound.
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Kinetics of the Exothermic Decomposition Reaction of 3,7-Dinitroimino-2,4- diazabiscyclo[3,3,0]octane

doi: 10.1088/1674-0068/17/6/783-786
Funds:  Project supported by the Science and Technology Foundation of Shanxi Key Laboratory of Physico-Inorganic Chemistry (29-3, 2001) and the Science and Technology Foundation of the National Defense Key Laboratory of Propellant and Explosive Combustion of Chin

Abstract: The kinetic parameters of the exothermic decomposition reaction of the title compound in a temperature-programmed mode have been studied by means of DSC. The DSC data obtained are fitted to the integral, differential and exothermic rate equations by linear least-squares, iterative, combined dichotomous and least-squares methods, respectively. After establishing the most probable general expression of differential and integral mechanism functions by the logical choice method, the corresponding values of the apparent activation energy (Ea), pre-exponential factor (A) and reaction order (n) will be obtained by the exothermic rate equation. The results show that the empirical kinetic model function in differential form and the values of Ea and A of this reaction are (1-α)0.44, 230.4 kJ/mol and 1018.16 s-1, respectively. With the help of the heating rate and obtained kinelic parameters, the kinetic equation of the exothermic decomposition reaction process of the title compound is proposed. The critical temperature of thermal explosion of the compound is 302.6℃. The above-mentioned kinetic parameters are quite useful for analyzing and evaluating the stability and thermal change rule of the title compound.

Hu Rongzu, Song Jirong, Zhao Fangqi, Wang Bozhou, Gao Shengli, Zhu Chanhua, Chen Pei, Luo Yang, Ning Binke, Chen Sanping, Shi Qizhen. Kinetics of the Exothermic Decomposition Reaction of 3,7-Dinitroimino-2,4- diazabiscyclo[3,3,0]octane[J]. Chinese Journal of Chemical Physics , 2004, 17(6): 783-786. doi: 10.1088/1674-0068/17/6/783-786
Citation: Hu Rongzu, Song Jirong, Zhao Fangqi, Wang Bozhou, Gao Shengli, Zhu Chanhua, Chen Pei, Luo Yang, Ning Binke, Chen Sanping, Shi Qizhen. Kinetics of the Exothermic Decomposition Reaction of 3,7-Dinitroimino-2,4- diazabiscyclo[3,3,0]octane[J]. Chinese Journal of Chemical Physics , 2004, 17(6): 783-786. doi: 10.1088/1674-0068/17/6/783-786

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