5,7-Dinitro-2,1,3-Benzoxadiazole-4,6-Diamine 3-Oxide

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Formula C6H4N6O6
IUPAC Name 5,7-dinitro-3-oxido-2,1,3-benzoxadiazol-3-ium-4,6-diamine
Molecular Mass 256.133 g·mol−1
Heat of Formation 657.9 ± 16.7 kJ·mol−1
Dipole Moment 0.00 ± 1.08 D
Volume 217.93 Å 3
Surface Area 210.76 Å 2
HOMO Energy -10.30 ± 0.55 eV
LUMO Energy -1.75 ± eV
Point Group Symmetry C3h
InChIKey DHPCKRKOYCSXCX-UHFFFAOYSA-N
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