THERMAL DECOMPOSITION OF 3-NITRO-1-NITROMETHYL-1,2,4-1H-TRIAZOLE IN SOLUTION

Authors

  • Р. С. Степанов Siberian State Technological University, Krasnoyarsk 660049
  • Л. А. Круглякова Siberian State Technological University, Krasnoyarsk 660049
  • О. А. Голубцова Siberian State Technological University, Krasnoyarsk 660049
  • А. М. Астахов Siberian State Technological University, Krasnoyarsk 660049

Keywords:

heterocyclic nitro compounds, 3-nitro-1-nitromethyl-1,2,4-1H-triazole, thermal decomposition, energy-rich substances

Abstract

The thermal decomposition of 3-nitro-1-nitromethyl-1,2,4-1H-triazole in 1% solution in phenyl benzoate proceeds homolytically with initial rupture of the CH2–NO2 bond. Activation parameters of the process were Ea = 172.6 kJ/mol, log A = 14.25. The initial basic pathway of fragmentation of the molecule under electron impact coincides with the first step of thermal decomposition, which is in agreement with X-ray structural and calculated quantum chemical data on bond stability in the molecule.

How to Cite
Stepanov, R. S.; Kruglyakova, L. A.; Golubtsova, O. A.; Astakhov, A. M. Chem. Heterocycl. Compd. 2003, 39, 604. [Khim. Geterotsikl. Soedin. 2003, 699.]

For this article in the English edition, see DOI https://doi.org/10.1023/A:1025142015046

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Published

2003-05-25

Issue

No. 5 (2003)

Section

Original Papers