2,4,4-Trimethyl-8-Nitro-3H-Imidazo[1,5-D][1,2,4]Triazin-5-Ium-8-Ylium-1-One

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Formula C8H12N5O3
IUPAC Name 2,4,4-trimethyl-8-nitro-3h-imidazo[1,5-d][1,2,4]triazin-5-ium-8-ylium-1-one
Molecular Mass 226.213 g·mol−1
Heat of Formation 80.3 ± 16.7 kJ·mol−1
Dipole Moment 9.83 ± 1.08 D
Volume 252.92 Å 3
Surface Area 228.94 Å 2
HOMO Energy -9.94 ± 0.55 eV
LUMO Energy -1.08 ± eV
Point Group Symmetry C1
InChIKey NPIJDTUJFVGAKK-UHFFFAOYSA-N
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