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This article is cited in 3 scientific papers (total in 3 papers)
Standard enthalpy of formation of a CL-20 bimolecular crystal with tris-oxadiazol-azepin and its thermal stability
A. I. Kazakov, T. K. Goncharov, D. B. Lempert, N. A. Plishkin, K. V. Bozhenko, A. N. Utenyshev, D. V. Dashko, A. I. Stepanov, S. M. Aldoshin Institute of Problems of Chemical Physics, Russian Academy of Sciences, Chernogolovka, 142432, Russia
Abstract:
The standard enthalpies of combustion and formation of 7$H$-tris([1,2,5]oxadiazol)[3,4-b:3',4'-d:3',4'-f]azepin, its bimolecular crystal with the $\gamma$-polymorph (CL-20), and $\gamma$-polymorphs of CL-20 are experimentally determined. The standard enthalpies of formation of the bimolecular crystal and the equimolecular mechanical mixture of $\gamma$-CL-20 with azepin are found to differ by less than 12.8 kJ/mol. This small difference is validated by quantum-chemical calculations. It is experimentally observed that the presence of azepin in the bimolecular crystal inhibits thermal decomposition of $\gamma$-CL-20 and increases the thermal stability of $\gamma$-CL-20 in the bimolecular crystal as compared to $\gamma$-CL-20 in the initial state.
Keywords:
enthalpy of combustion, enthalpy of formation, cocrystallization, polymorph of CL-20, bimolecular crystals, thermal stability.
Received: 22.02.2017
Citation:
A. I. Kazakov, T. K. Goncharov, D. B. Lempert, N. A. Plishkin, K. V. Bozhenko, A. N. Utenyshev, D. V. Dashko, A. I. Stepanov, S. M. Aldoshin, “Standard enthalpy of formation of a CL-20 bimolecular crystal with tris-oxadiazol-azepin and its thermal stability”, Fizika Goreniya i Vzryva, 54:1 (2018), 99–107; Combustion, Explosion and Shock Waves, 54:1 (2018), 89–96
Linking options:
https://www.mathnet.ru/eng/fgv480 https://www.mathnet.ru/eng/fgv/v54/i1/p99
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