Literature DB >> 18394793

Synthesis, structural investigation, thermal decomposition mechanism and sensitivity properties of an energetic compound [Cd(DAT)(6)](ClO(4))(2) (DAT=1,5-diaminotetrazole).

Yan Cui1, Jianguo Zhang, Tonglai Zhang, Li Yang, Jin Zhang, Xiaochun Hu.   

Abstract

An energetic coordination compound [Cd(DAT)(6)](ClO(4))(2) has been synthesized by using 1,5-diaminotetrazole (DAT) as ligand and its structure has been characterized by applying X-ray single crystal diffraction, elemental analysis and FT-IR spectroscopy. The central cadmium(II) cation is coordinated by six N atoms from six DAT molecules to form a six-coordinated and distorted octahedral structure. Di-dimension layer structure was formed and the layers were linked together by the extensive intermolecular hydrogen bonds between DAT ligands and ClO(4)(-) anions. Thermal decomposition mechanism of the title compound was predicted based on DSC, TG-DTG and FT-IR analyses results. The kinetic parameters of the first exothermic process of the title compound were studied by applying the Kissinger's and Ozawa-Doyle's methods. Sensitivity tests reveal that the title compound has sensitive nature.

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Year:  2008        PMID: 18394793     DOI: 10.1016/j.jhazmat.2008.02.078

Source DB:  PubMed          Journal:  J Hazard Mater        ISSN: 0304-3894            Impact factor:   10.588


  3 in total

1.  Theoretical study on novel nitrogen-rich energetic compounds of bis(amino)-azobis(azoles) with tetrazene unit.

Authors:  Zhi-Min Li; Dan-Dan Zeng; Jian-Guo Zhang; Xiao-Qing Niu; Tian-Tian Man; Shao-Wen Zhang; Tong-Lai Zhang
Journal:  J Mol Model       Date:  2012-06-02       Impact factor: 1.810

2.  Theoretical studies on densities, stability and detonation properties of 2D polymeric complexes Cu(DAT)₂Cl₂ and its new analogues Zn(DAT)₂Cl₂.

Authors:  Yuanjie Shu; Huarong Li; Shijie Gao; Ying Xiong
Journal:  J Mol Model       Date:  2012-12-29       Impact factor: 1.810

3.  Theoretical study on the tautomerization of 1,5-diaminotetrazole (DAT).

Authors:  Piao He; Jian-Guo Zhang; Li-Na Feng; Kun Wang; Tong-Lai Zhang; Shao-Wen Zhang
Journal:  J Mol Model       Date:  2014-09-21       Impact factor: 1.810

  3 in total

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