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Synthesis,Crystal Structure and Thermal Decomposition of Triaminoguanidinium 2,4,6-Trioxo-1,3,5-triazinan-1-ide Based on Cyanuric Acid
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(1. Research Center of Laser Fusion, China Academy of Engineering Physics, Mianyang 621999, China; 2.State Key Laboratory Cultivation Base for Nonmetal Composites and Functional Materials, Southwest University of Science and Technology, Mianyang 621010, China; 3. School of National Defence Science and Technology, Southwest University of Science and Technology, Mianyang 621010, China)

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    Abstract:

    A nitrogen-rich energetic compound-triaminoguanidinium 2, 4, 6-trioxo-1, 3, 5-triazinan-1-ide (1) was prepared with a yield of 91% via one-step metathesis reaction using triaminoguanidinium hydrochloride (TAG-HCl) and sodium cyanurate (CANa) as raw materials. The structure of the product was characterized by X-ray single-crystal diffraction, UV-Vis, FT-IR, 1H NMR, mass spectrometry and elemental analysis. The enthalpy of formation and detonation parameters of the product were calculated. Its thermal stability, non-isothermal reaction kinetics and decomposition process were studied by differential scanning calorimetry(DSC) at a heating rate of 10 K·min-1 and thermogravimetric (TG) analysis coupled with Fourier transform infrared spectroscopy (FTIR). The impact sensitivity of the product was determined by the drop hammer test. Results show that the crystal of compound 1 is monoclinic, space group P21/n with a calculated density of 1.676 g·cm-3. Its enthalpy of formation is 327.9 kJ mol-1, the detonation velocity 7900 m·s-1, and the detonation pressure 26.5 GPa. Probable thermal decomposition mechanism of 1 under N2 atmosphere as shown in the text is proposed. Compound 1 is very insensitive to impact, and the impact sensitivity is greater than 60 J, which is better than that of TATB (50 J).

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刘强强,金波,张青春,等.三聚氰酸为基的2,4,6-三氧-[1,3,5]三嗪烷-1-三氨基胍盐的合成、晶体结构和热性能(英)[J].含能材料,2017,25(10):829-837.
LIU Qiang-qiang, JIN Bo, ZHANG Qing-chun, et al. Synthesis, Crystal Structure and Thermal Decomposition of Triaminoguanidinium 2,4,6-Trioxo-1,3,5-triazinan-1-ide Based on Cyanuric Acid[J]. Chinese Journal of Energetic Materials,2017,25(10):829-837.

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History
  • Received:March 30,2017
  • Revised:June 13,2017
  • Adopted:June 26,2017
  • Online: October 26,2017
  • Published: November 06,2017