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Comparative Study of Various Pyrazole-based Anions: A Promising Family of Ionic Derivatives as Insensitive Energetic Materials.

Ping YinLauren A MitchellDamon A ParrishJean'ne M Shreeve
Published in: Chemistry, an Asian journal (2017)
In the design of advanced energetic materials, high-density explosophores play a pivotal role because of their remarkable enhancement of both density and molecular stability. Using diversified functionalization strategies, a comparative study involving various nitropyrazole anions shows that these are crucially important in determining performance and stability. A promising family of pyrazole-based energetic ionic derivatives were synthesized and characterized by NMR and IR spectroscopies, and elemental analysis. Among them, 7, 8, 11-13 exhibit favorable overall performance as energetic materials.
Keyphrases
  • ionic liquid
  • high density
  • solid state
  • molecular docking
  • magnetic resonance
  • high resolution
  • single molecule
  • mass spectrometry
  • structure activity relationship
  • data analysis