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

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Formula C5H12N5O2+
IUPAC Name (2s,3s,4s,5r)-2-amino-3-hydroxy-1,2,3,4,5,7,8,9-octahydropurin-3-ium-6-one
Molecular Mass 174.181 g·mol−1
Heat of Formation 67.3 ± 16.7 kJ·mol−1
Dipole Moment 3.55 ± 1.08 D
Volume 170.16 Å 3
Surface Area 171.78 Å 2
HOMO Energy -9.51 ± 0.55 eV
LUMO Energy 2.07 ± eV
Point Group Symmetry C1
InChIKey AHHATUHFYSWYTH-UHFFFAOYSA-O
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