Synthesis, crystal structure, and properties of an energetic compound [Zn(1, 5-diaminotetrazole)6](ClO4)2

Jing Shang; Jianguo Zhang; Yan Cui; Tonglai Zhang; Yuanjie Shu; Li Yang

Synthesis, crystal structure, and properties of an energetic compound [Zn(1, 5-diaminotetrazole)₆](ClO₄)₂

Jing Shang, Jianguo Zhang^*, Yan Cui, Tonglai Zhang, Yuanjie Shu, Li Yang

^*Corresponding author for this work

School of Mechatronical Engineering

Research output: Contribution to journal › Article › peer-review

15 Citations (Scopus)

Abstract

An environmentally friendly energetic coordination compound [Zn(DAT)₆](ClO₄)₂ (DAT= 1, 5-diaminotetrazole) has been synthesized by using DAT as ligand, characterized by elemental analysis and FT-IR spectroscopy. The single crystal structure of the title compound was determined by applying X-ray single crystal diffraction, which shows that the crystal belongs to trigonal crystal system with space group P3̄, and its crystal parameters: a=b=1.18398(9) nm, c=0.65700(10) nm, γ=120°, V=0.79760(15) nm³, and Z=1. There are one Zn²⁺, six DAT molecules and two ClO₄^- in the minimum asymmetric unit of the title compound. The central zinc(II) cation is coordinated by six N atoms from six DAT molecules to form a six-coordinated and distorted octahedral structure. Thermal decomposition mechanism of [Zn(DAT)₆]-(ClO₄)₂ was predicted based on DSC, TG-DTG and FT-IR analysis results. Also the kinetic parameters of the first exothermic process and sensitivities of the title compound have been studied. The result shows that the title compound has good friction sensitivity.

Original language	English
Pages (from-to)	233-238
Number of pages	6
Journal	Acta Chimica Sinica
Volume	68
Issue number	3
Publication status	Published - 14 Feb 2010

Keywords

1, 5-diaminotetrazole
Crystal structure
Sensitivity
Thermal decomposition mechanism

Cite this

@article{a34be7ceaf3b4d0cb5b6b959ca36b7b8,

title = "Synthesis, crystal structure, and properties of an energetic compound [Zn(1, 5-diaminotetrazole)6](ClO4)2",

abstract = "An environmentally friendly energetic coordination compound [Zn(DAT)6](ClO4)2 (DAT= 1, 5-diaminotetrazole) has been synthesized by using DAT as ligand, characterized by elemental analysis and FT-IR spectroscopy. The single crystal structure of the title compound was determined by applying X-ray single crystal diffraction, which shows that the crystal belongs to trigonal crystal system with space group P{\=3}, and its crystal parameters: a=b=1.18398(9) nm, c=0.65700(10) nm, γ=120°, V=0.79760(15) nm3, and Z=1. There are one Zn2+, six DAT molecules and two ClO4- in the minimum asymmetric unit of the title compound. The central zinc(II) cation is coordinated by six N atoms from six DAT molecules to form a six-coordinated and distorted octahedral structure. Thermal decomposition mechanism of [Zn(DAT)6]-(ClO4)2 was predicted based on DSC, TG-DTG and FT-IR analysis results. Also the kinetic parameters of the first exothermic process and sensitivities of the title compound have been studied. The result shows that the title compound has good friction sensitivity.",

keywords = "1, 5-diaminotetrazole, Crystal structure, Sensitivity, Thermal decomposition mechanism",

author = "Jing Shang and Jianguo Zhang and Yan Cui and Tonglai Zhang and Yuanjie Shu and Li Yang",

year = "2010",

month = feb,

day = "14",

language = "English",

volume = "68",

pages = "233--238",

journal = "Acta Chimica Sinica",

issn = "0567-7351",

publisher = "Science China Press",

number = "3",

}

TY - JOUR

T1 - Synthesis, crystal structure, and properties of an energetic compound [Zn(1, 5-diaminotetrazole)6](ClO4)2

AU - Shang, Jing

AU - Zhang, Jianguo

AU - Cui, Yan

AU - Zhang, Tonglai

AU - Shu, Yuanjie

AU - Yang, Li

PY - 2010/2/14

Y1 - 2010/2/14

N2 - An environmentally friendly energetic coordination compound [Zn(DAT)6](ClO4)2 (DAT= 1, 5-diaminotetrazole) has been synthesized by using DAT as ligand, characterized by elemental analysis and FT-IR spectroscopy. The single crystal structure of the title compound was determined by applying X-ray single crystal diffraction, which shows that the crystal belongs to trigonal crystal system with space group P3̄, and its crystal parameters: a=b=1.18398(9) nm, c=0.65700(10) nm, γ=120°, V=0.79760(15) nm3, and Z=1. There are one Zn2+, six DAT molecules and two ClO4- in the minimum asymmetric unit of the title compound. The central zinc(II) cation is coordinated by six N atoms from six DAT molecules to form a six-coordinated and distorted octahedral structure. Thermal decomposition mechanism of [Zn(DAT)6]-(ClO4)2 was predicted based on DSC, TG-DTG and FT-IR analysis results. Also the kinetic parameters of the first exothermic process and sensitivities of the title compound have been studied. The result shows that the title compound has good friction sensitivity.

AB - An environmentally friendly energetic coordination compound [Zn(DAT)6](ClO4)2 (DAT= 1, 5-diaminotetrazole) has been synthesized by using DAT as ligand, characterized by elemental analysis and FT-IR spectroscopy. The single crystal structure of the title compound was determined by applying X-ray single crystal diffraction, which shows that the crystal belongs to trigonal crystal system with space group P3̄, and its crystal parameters: a=b=1.18398(9) nm, c=0.65700(10) nm, γ=120°, V=0.79760(15) nm3, and Z=1. There are one Zn2+, six DAT molecules and two ClO4- in the minimum asymmetric unit of the title compound. The central zinc(II) cation is coordinated by six N atoms from six DAT molecules to form a six-coordinated and distorted octahedral structure. Thermal decomposition mechanism of [Zn(DAT)6]-(ClO4)2 was predicted based on DSC, TG-DTG and FT-IR analysis results. Also the kinetic parameters of the first exothermic process and sensitivities of the title compound have been studied. The result shows that the title compound has good friction sensitivity.

KW - 1, 5-diaminotetrazole

KW - Crystal structure

KW - Sensitivity

KW - Thermal decomposition mechanism

UR - http://www.scopus.com/inward/record.url?scp=79951491402&partnerID=8YFLogxK

M3 - Article

AN - SCOPUS:79951491402

SN - 0567-7351

VL - 68

SP - 233

EP - 238

JO - Acta Chimica Sinica

JF - Acta Chimica Sinica

IS - 3

ER -

Synthesis, crystal structure, and properties of an energetic compound [Zn(1, 5-diaminotetrazole)₆](ClO₄)₂

Abstract

Keywords

Other files and links

Fingerprint

Cite this