Structural and Theoretical Investigation of 3,4,5-Triamino-1,2,4-Triazolium Salts

Abstract

Reactions using the high nitrogen heterocycle 3,4,5-triamino-1,2,4-triazole (guanazine) with strong acids (HN03, HCl04, and "HN(N02)2") resulted in a family of highly stable salts. All of the salts were characterized using spectroscopic as well as single crystal x-ray diffraction studies. The x-ray structures are compared to that obtained from theoretical calculations (MP2/6-311+G(d,p) level). Initial safety testing (impact, friction) was carried out on all of the new materials.

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Document Details

Document Type
Technical Report
Publication Date
Jul 01, 2004
Accession Number
ADA427861

Entities

People

  • Adam J. Brand
  • Gregory W. Drake
  • Jerry A. Boatz
  • Leslie Hall
  • Tommy W. Hawkins

Organizations

  • Air Force Research Laboratory

Tags

Communities of Interest

  • Advanced Electronics
  • Air Platforms
  • C4I
  • Weapons Technologies

DTIC Thesaurus Topics

  • Air Force Research Laboratories
  • Chemical Synthesis
  • Chemistry
  • Crystal Structure
  • Crystals
  • Diffraction
  • Energetic Materials
  • Materials
  • Organic Chemistry
  • Radiation
  • Raman Spectra
  • Raman Spectroscopy
  • Single Crystals
  • Spectra
  • Spectroscopy
  • X Rays
  • X-Ray Diffraction

Readers

  • Agricultural Chemistry/Soil Science
  • Organic Chemistry
  • Structural Health Monitoring of Composite Structures.