Crystal structure and computed properties of a coordination compound [Zn(ATZ)2(N3)2]3(H2O)2 (ATZ=4-Amino-1,2,4-triazole)

被引：1

作者：

Xue, Rui ^{[1
]}

Song, Jun-Hui ^{[1
]}

机构：

[1] Xinyang Normal Univ, Coll Comp & Informat Technol, Xinyang 464000, Peoples R China

来源：

MAIN GROUP CHEMISTRY | 2016年 / 15卷 / 03期

关键词：

Zinc; 4-amino-1; 2; 4-triazole; azides; THERMAL-DECOMPOSITION; ENERGETIC MATERIALS; EXPLOSIVES; DERIVATIVES; CHEMISTRY;

D O I：

10.3233/MGC-160209

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

A nitrogen-rich coordination compound [Zn(ATZ)(2)(N-3)(2)](3)(H2O)(2) (1, ATZ = 4-amino-1,2,4-triazole) was prepared and fully characterized. The crystal structure is triclinic, space group P2(1)/n. Thermal decomposition mechanisms of the compound were predicted based on DSC, TG-DTG and FTIR analyses. The kinetic parameters of the first exothermic process of 1 were studied both by the Kissinger's method and Ozawa-Doyle's method. The critical temperature of thermal explosion, entropies of activation (Delta S-not equal), enthalpies of activation (Delta H-not equal), and free energies of activation (Delta G(not equal)) were calculated.

引用

页码：287 / 294

页数：8

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