On the Mechanism of Thermal Decomposition of 1,1-Diamino-2,2-dinitroethene (FOX-7) and its Cyclic Derivatives

被引：11
|
作者：
Krisyuk, Boris E. [1 ]
Zakharov, Viktor V. [1 ]
Chukanov, Nikita V. [1 ]
机构：
[1] Russian Acad Sci, Inst Problems Chem Phys, Chernogolovka 142432, Moscow Region, Russia
来源：
CENTRAL EUROPEAN JOURNAL OF ENERGETIC MATERIALS | 2020年 / 17卷 / 01期
关键词：
quantum-chemical calculations; FOX-7; thermal decomposition; DSC; TG; ENERGY DENSITY MATERIAL;
D O I：
10.22211/cejem/118513
中图分类号：
O69 [应用化学];
学科分类号：
081704 ;
摘要：
The thermal decomposition of 1,1-diamino-2,2-dinitroethene (I) and its cyclic derivatives 2-(dinitromethylene)-1,3-diazacyclopentane (II), 2-(dinitromethylene)- 1,3-diazacyclohexane (III) and 2-(dinitromethylene)1,3-diazacycloheptane (IV) was investigated by quantum chemistry methods (PBE/cc-pVDZ), as well as DSC and TG. According to both the theoretical and experimental data, the thermal stability of compounds I-IV increases in the sequence IV < I approximate to III < II.
引用
收藏
页码：20 / 30
页数：11
相关论文
共 50 条
  • [31] Modelling of the Synthesis of 1,1-Diamino-2,2-dinitroethene (DADNE)
    Trzcinski, Waldemar A.
    Chylek, Zbigniew
    CENTRAL EUROPEAN JOURNAL OF ENERGETIC MATERIALS, 2012, 9 (02): : 101 - 117
  • [32] Derivatives of 1,1-Diamino-2,2-dinitroethene (DADNE) and Specific Reactivity Understanding
    Herve, Gregoire
    PROPELLANTS EXPLOSIVES PYROTECHNICS, 2009, 34 (05) : 444 - 451
  • [33] Chemical decomposition in shock-compressed 1,1-diamino-2,2-dinitroethene (FOX-7) single crystals: Time-resolved Raman spectroscopy
    Winey, J. M.
    Zimmerman, K.
    Gupta, Y. M.
    JOURNAL OF APPLIED PHYSICS, 2025, 137 (11)
  • [34] Kinetics of the Decomposition of 1,1-Diamino-2,2-Dinitroethylene (FOX-7). Part 4: Comparison of the Decomposition Reactions of FOX-7 and Its Diazacyclic Derivatives
    G. M. Nazin
    V. V. Dubikhin
    A. I. Kazakov
    A. V. Nabatova
    B. E. Krisyuk
    N. N. Volkova
    A. V. Shastin
    Russian Journal of Physical Chemistry B, 2022, 16 : 308 - 315
  • [35] Kinetics of the Decomposition of 1,1-Diamino-2,2-Dinitroethylene (FOX-7). Part 4: Comparison of the Decomposition Reactions of FOX-7 and Its Diazacyclic Derivatives
    Nazin, G. M.
    Dubikhin, V. V.
    Kazakov, A., I
    Nabatova, A., V
    Krisyuk, B. E.
    Volkova, N. N.
    Shastin, A., V
    RUSSIAN JOURNAL OF PHYSICAL CHEMISTRY B, 2022, 16 (02) : 308 - 315
  • [36] Low sensitive high explosives. 1,1-diamino-2,2-dinitroethene
    Powala, Dorota
    Orzechowski, Andrzej
    Florczak, Bogdan
    Maranda, Andrzej
    PRZEMYSL CHEMICZNY, 2007, 86 (06): : 510 - 514
  • [37] Review on the Reactivity of 1,1-Diamino-2,2-dinitroethylene (FOX-7)
    Zhang, Yu
    Sun, Qian
    Xu, Kangzhen
    Song, Jirong
    Zhao, Fengqi
    PROPELLANTS EXPLOSIVES PYROTECHNICS, 2016, 41 (01) : 35 - 52
  • [38] MOLECULE DESIGN AND PROPERTIES OF CYCLIC ENERGETIC MATERIALS BASED ON NITROGUANIDINE AND 1,1-DIAMINO-2,2-DINITROETHENE
    Xiao Menghui
    Jin Xinghui
    Zhou Jianhua
    Hu Bingcheng
    QUIMICA NOVA, 2019, 42 (02): : 181 - 191
  • [39] Phase Diagram and Decomposition of 1,1-Diamino-2,2-dinitroethene Single Crystals at High Pressures and Temperatures
    Dreger, Zbigniew A.
    Tao, Yuchuan
    Gupta, Yogendra M.
    JOURNAL OF PHYSICAL CHEMISTRY C, 2016, 120 (20): : 11092 - 11098
  • [40] Initial decomposition pathways of 1,1-diamino-2,2-dinitroethylene (α-FOX-7) in the condensed phase
    Yadav, Komal
    Luo, Yuheng
    Kaiser, Ralf I.
    Sun, Rui
    PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2024, 26 (15) : 11395 - 11405
12345