2-Amino-8-Nitro-3,7-Dihydropurine-1,9-Diium-5-Id-6-One

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Formula C5H6N6O3+
IUPAC Name 2-amino-8-nitro-3,7-dihydropurine-1,9-diium-5-id-6-one
Molecular Mass 198.139 g·mol−1
Heat of Formation 137.5 ± 16.7 kJ·mol−1
Dipole Moment 5.39 ± 1.08 D
Volume 191.92 Å 3
Surface Area 194.2 Å 2
HOMO Energy -9.93 ± 0.55 eV
LUMO Energy 1.23 ± eV
Point Group Symmetry C1
InChIKey RZICEDNELILNFK-UHFFFAOYSA-O
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