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Thermochemistry of diphenic anhydride. A combined experimental and theoretical study

✍ Scribed by Matos, M. Agostinha R.; Miranda, Margarida S.; Pinto, Natália A. B.; Morais, Victor M. F.; Dhananjaya, N.; Liebman *, Joel F.

Book ID
126633364
Publisher
Taylor and Francis Group
Year
2005
Tongue
English
Weight
173 KB
Volume
103
Category
Article
ISSN
0026-8976

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The thermal decomposition of three ni- (TNMA,3), were studied experimentally, and the reaction energies were calculated quantum-chemically [B3LYP/6-31G(d)//PM3/ ]. The compound that was most promising as a potential high energy density material (HEDM) was found to be 1,3-5-(NO 2 ) 3 -2,4,6-(N 3 ) 3