3,4,5-Trinitro-1H-Pyrazole

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Properties Simple | Detailed

Formula C3HN5O6
IUPAC Name 3,4,5-trinitropyrazol-1-ium-2-ide
Molecular Mass 203.070 g·mol−1
Heat of Formation 274.6 ± 16.7 kJ·mol−1
Dipole Moment 5.03 ± 1.08 D
Volume 184.99 Å 3
Surface Area 183.04 Å 2
HOMO Energy -11.93 ± 0.55 eV
LUMO Energy 0.34 ± eV
Point Group Symmetry Cs
InChIKey YLTPBDJQPIRWTQ-UHFFFAOYSA-N
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