CHINESE JOURNAL OF ENERGETIC MATERIALS
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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)
作者:
作者单位:

(1. 中国工程物理研究院激光聚变研究中心,四川 绵阳 621999; 2. 西南科技大学四川省非金属复合与功能材料重点实验室——省部共建国家重点实验室培育基地,四川 绵阳 621010; 3. 西南科技大学国防科技学院,四川 绵阳 621010)

作者简介:

LIU Qiang-qiang (1987-), male,Ph. D, research field: the synthesis of energetic materials, e-mail:liuqq87@163.com Corresponding Author: JIN Bo (1982-), male, professor, major in synthesis and property of energetic materials, e-mail:jinbo0428@163.com; PENG Ru-fang (1967-), female, professor, research field: fullerene chemistry and the synthesis and property of energetic materials, e-mail:rfpeng2006@163.com

通讯作者:

JIN Bo (1982-), male, professor, major in synthesis and property of energetic materials, e-mail:jinbo0428@163.com; PENG Ru-fang (1967-), female, professor, research field: fullerene chemistry and the synthesis and property of energetic materials, e-mail:rfpeng2006@163.com

基金项目:

National Natural Science Foundation of China (51372211), Open Project of State Key Laboratory Cultivation Base for Nonmetal Composites and Functional (14tdfk05), Southwest University of Science and Technology Outstanding Youth Fundation (13zx9107).Biography: LIU Qiang-qiang (1987-), male,Ph. D, research field: the synthesis of energetic materials, e-mail:liuqq87@163.com


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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Affiliation:

(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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    摘要:

    以三聚氰酸钠(CANa)和三氨基胍盐酸盐(TAG-HCl)为原料,通过一步复分解反应制备了一种富氮含能化合物——2,4,6-三氧-[1, 3, 5]三嗪烷-1-三氨基胍盐(1),收率91%。采用X-射线单晶衍射、UV-Vis、FTIR、1H NMR以及元素分析等对产物进行了结构表征。计算了产物的生成焓和爆轰参数。通过差示扫描量热法(DSC,10 K·min-1)和热重-傅里叶变换红外光谱联用分析了其热稳定性、非等温热分解动力学和热分解过程。通过落锤法测试了产物的撞击感度。结果表明,化合物1的晶体为单斜晶系,P21/n空间群,计算密度为1.676 g·cm-3,生成焓为327.9 kJ·mol-1,爆速为7900 m·s-1,爆压为26.5 GPa。化合物具1有良好的热稳定性,分解峰值温度为538.9 K,提出了N2气氛下可能的热分解机理。且化合物1对撞击非常钝感,撞击感度大于60 J,优于TATB(50 J)。

    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. DOI:10.11943/j. issn.1006-9941.2017.10.007.
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. DOI:10.11943/j. issn.1006-9941.2017.10.007.

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  • 收稿日期: 2017-03-30
  • 最后修改日期: 2017-06-13
  • 录用日期: 2017-06-26
  • 在线发布日期: 2017-10-26
  • 出版日期: 2017-11-06