3,7-Dimethyl-9H-Purine-4,5-Diide-2,6,8-Trione

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Formula C7H8N4O3
IUPAC Name 3,7-dimethyl-9h-purine-4,5-diide-2,6,8-trione
Molecular Mass 196.163 g·mol−1
Heat of Formation -410.6 ± 16.7 kJ·mol−1
Dipole Moment 2.93 ± 1.08 D
Volume 208.55 Å 3
Surface Area 201.16 Å 2
HOMO Energy -8.74 ± 0.55 eV
LUMO Energy 2.33 ± eV
Point Group Symmetry Cs
InChIKey GQVVPEYNJAWLHQ-UHFFFAOYSA-P
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