3-Hydroxy-7H-Purine-1,9-Diium-5-Id-6-One

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Formula C5H5N4O2+
IUPAC Name 3-hydroxy-7h-purine-1,9-diium-5-id-6-one
Molecular Mass 153.119 g·mol−1
Heat of Formation 84.2 ± 16.7 kJ·mol−1
Dipole Moment 4.09 ± 1.08 D
Volume 155.97 Å 3
Surface Area 159.46 Å 2
HOMO Energy -9.54 ± 0.55 eV
LUMO Energy 1.85 ± eV
Point Group Symmetry C1
InChIKey ZECADWAOKUVENE-UHFFFAOYSA-O
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