7-[(2S)-2,3-Dihydroxypropyl]-1,3-Dimethyl-Purin-9-Ium-5-Ide-2,6-Dione

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Properties Simple | Detailed

Formula C10H15N4O4
IUPAC Name 7-[(2s)-2,3-dihydroxypropyl]-1,3-dimethyl-purin-9-ium-5-ide-2,6-dione
Molecular Mass 255.250 g·mol−1
Heat of Formation -593.0 ± 16.7 kJ·mol−1
Dipole Moment 2.33 ± 1.08 D
Volume 280.59 Å 3
Surface Area 258.46 Å 2
HOMO Energy -9.19 ± 0.55 eV
LUMO Energy 2.27 ± eV
Point Group Symmetry C1
InChIKey UBRCWWYWWKQNJA-KKMMWDRVSA-P
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