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Chemistry of Heterocyclic Compounds

, Volume 51, Issue 8, pp 760–762 | Cite as

Synthesis and theoretical prediction of detonation properties of 3-azido-4-[(4-nitrofurazan-3-yl)-ONN-azoxy]furazan

  • Xionghui Wu
  • Yuting Chu
  • Chunmei Zheng
  • Tianyi Wang
  • Wu Lei
  • Fengyun Wang
  • Mingzhu XiaEmail author
Article

The high energy density compound 3-azido-4-[(4-nitrofurazan-3-yl)-ONN-azoxy]furazan was synthesized from 3-amino-4-[(4-azidofurazan-3-yl)-NNO-azoxy]furazan by a catalytic oxidation process. The structure of the compound was characterized by IR, NMR spectroscopy and elemental analysis. The detonation performance of this compound was estimated by using density functional theory and the Monte Carlo method. The calculations predicted the density of the compound was 1.88 g·cm–3, the heat of detonation 1780.65 J·g–1, the detonation velocity 9150 m·s–1, and the detonation pressure 37.46 GPa.

Keywords

furazan energetic material azidation detonation performance oxidation synthesis 

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Copyright information

© Springer Science+Business Media New York 2015

Authors and Affiliations

  • Xionghui Wu
    • 1
  • Yuting Chu
    • 1
  • Chunmei Zheng
    • 1
  • Tianyi Wang
    • 1
  • Wu Lei
    • 1
  • Fengyun Wang
    • 1
  • Mingzhu Xia
    • 1
    Email author
  1. 1.Nanjing University of Science and TechnologyNanjingChina

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