SYNTHESIS AND THEORETICAL PREDICTION OF DETONATION PROPERTIES OF 3-AZIDO-4-[(4-NITROFURAZAN-3-YL)-<i>ONN</i>-AZOXY]FURAZAN

Authors

  • Xionghui Wu Department of Chemistry, Nanjing University of Science and Technology, Nanjing 210094
  • Yuting Chu Department of Chemistry, Nanjing University of Science and Technology, Nanjing 210094
  • Chunmei Zheng Department of Chemistry, Nanjing University of Science and Technology, Nanjing 210094
  • Tianyi Wang Department of Chemistry, Nanjing University of Science and Technology, Nanjing 210094
  • Wu Lei Department of Chemistry, Nanjing University of Science and Technology, Nanjing 210094
  • Fengyun Wang Department of Chemistry, Nanjing University of Science and Technology, Nanjing 210094
  • Mingzhu Xia Department of Chemistry, Nanjing University of Science and Technology, Nanjing 210094

DOI:

https://doi.org/10.1007/2560

Keywords:

furazan, energetic material, azidation, detonation performance, oxidation, synthesis

Abstract

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.

How to Cite
Wu, X.; Chu, Y.; Zheng, C.; Wang, T.; Lei, W.; Wang, F.; Xia, M. Chem. Heterocycl. Compd. 2015, 51, 760. [Khim. Geterotsikl. Soedin. 2015, 51, 760.]

For this article in the English edition see DOI 10.1007/s10593-015-1772-8

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Published

2015-09-11

Issue

Vol. 51 No. 8 (2015)

Section

Original Papers