(2S)-2-Hydroxy-2,9-Dihydro-1H-Purine-6,8-Dione

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Formula C5H4N4O3
IUPAC Name (2s)-2-hydroxy-2,9-dihydro-1h-purine-6,8-dione
Molecular Mass 168.110 g·mol−1
Heat of Formation -213.3 ± 16.7 kJ·mol−1
Dipole Moment 3.61 ± 1.08 D
Volume 166.77 Å 3
Surface Area 170.2 Å 2
HOMO Energy -10.98 ± 0.55 eV
LUMO Energy 0.52 ± eV
Point Group Symmetry C1
InChIKey DZGSAURIFGGOJK-RXMQYKEDSA-N
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