1,7-Dimethyl-3,9-Dihydropurine-4,5-Diide-2,6,8-Trione

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Formula C7H10N4O3
IUPAC Name 1,7-dimethyl-3,9-dihydropurine-4,5-diide-2,6,8-trione
Molecular Mass 198.179 g·mol−1
Heat of Formation -407.3 ± 16.7 kJ·mol−1
Dipole Moment 1.67 ± 1.08 D
Volume 207.53 Å 3
Surface Area 201.06 Å 2
HOMO Energy -8.79 ± 0.55 eV
LUMO Energy 2.34 ± eV
Point Group Symmetry Cs
InChIKey XHJFXYZUCBTEKE-UHFFFAOYSA-Q
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