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Kinetics and Mechanism of the Exothermic First-stage Decomposition Reaction for 1,5-Dimethyl-2,6-bis(2,2,2-trinitroethyl)-glycoluril 被引量:2

Kinetics and Mechanism of the Exothermic First-stage Decomposition Reaction for 1,5-Dimethyl-2,6-bis(2,2,2-trinitroethyl)-glycoluril
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摘要 The thermal behavior, mechanism and kinetic parameters of the exothermic first-stage decomposition reaction of the title compound in a temperature-programmed mode have been investigated by means of DSC, TG-DTG and IR. The reaction mechanism was proposed. The empirical kinetic model functions in differential form, apparent activation energy (Ea) and pre-exponential factor (A) of this reaction are (1 - α) ?1.119, 211.3 kj/mol and 1020.2 s?1, respectively. The critical temperature of thermal explosion of the compound is 202.2 °C. The values of ΔS≠, ΔH≠ and CΔG≠ of this reaction are 143.8 J.mol?1.K?1, 208.7 kj/mol and 141.7 kj/mol, respectively. The thermal behavior, mechanism and kinetic parameters of the exothermic first-stage decomposition reaction of the title compound in a temperature-programmed mode have been investigated by means of DSC, TG-DTG and IR. The reaction mechanism was proposed. The empirical kinetic model functions in differential form, apparent activation energy (Ea) and pre-exponential factor (A) of this reaction are (1 - α) ?1.119, 211.3 kj/mol and 1020.2 s?1, respectively. The critical temperature of thermal explosion of the compound is 202.2 °C. The values of ΔS≠, ΔH≠ and CΔG≠ of this reaction are 143.8 J.mol?1.K?1, 208.7 kj/mol and 141.7 kj/mol, respectively.
出处 《Chinese Journal of Chemistry》 SCIE CAS CSCD 2002年第12期1494-1498,1460,共5页 中国化学(英文版)
基金 theScienceandTechnologyFoundationofShaanxiKeyLaboratoryofPhysicoInorganicChemistry(No.2 9 3,2 0 01)andtheEducationalSpecialFoundationofShaanxiProvince (No .0 1H0 8)
关键词 DECOMPOSITION GLYCOLURIL KINETICS mechanism decomposition glycoluril kinetics mechanism
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参考文献3

  • 1Zhang, T-L,Hu, R.-Z.,Xie, Y.,Li, F.-P. Thermochimica Acta . 1994
  • 2Hu, R.-Z.,Shi, Q.-Z.Thermal Analysis Kinetics[]..2001
  • 3Hu,R .Z,Liang,Y .J,Fang,Y .G,Wang,J.S,Xi,Y. J Therm.Anal . 1996

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