Synthesis and crystal structure of 2,2',5,5'-tetrachloro-1,1'-azo-1,3,4-triazole

Sheng Hua Li, Hong Gang Shi, Cheng Hui Sun, Xiao Tang Li, Si Ping Pang*, Yong Zhong Yu, Xin Qi Zhao

*Corresponding author for this work

Research output: Contribution to journalArticlepeer-review

8 Citations (Scopus)

Abstract

2,2',5,5'-tetrachloro-1,1'-azo-1,3,4-triazole (1) was synthesized by reaction of 4-amino-1,2,4-triazole and sodium dichloroisocyanurate( SDCI). Its structure was determined by X-ray single crystal diffraction. It crystallizes in the triclinicspace group P-1, with a = 6.2824 (13) Å, b =7.7173(15) Å3, c = 10.443(2) Å, α=89. 16(3) °, β=88.20(3) °, γ= 89.10(3)°, V = 505.94(18) Å3, Z = 2, Mr=301.92, Dc=1.982 mg · m-3, F(000) =296 and μ(MoKα) = 1.152 mm-1, the final R =0.0498 and ωR =0.1139. X-ray analysis reveals that a stronger IT interaction of the triazole units with the tetrazene moiety.

Original languageEnglish
Pages (from-to)7-10
Number of pages4
JournalHanneng Cailiao/Chinese Journal of Energetic Materials
Volume17
Issue number1
Publication statusPublished - Feb 2009

Keywords

  • 2,2',5,5'-tetrachloro-1, 1'-azo-1,3,4-triazole
  • Crystal structure
  • Nitrogen-rich compound
  • Organic chemisty
  • Synthesis

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