2-(3,7-Dimethyl-2,6-Dioxo-Purin-9-Ium-5-Id-1-Yl)Acetic Acid

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Formula C9H11N4O4
IUPAC Name 2-(3,7-dimethyl-2,6-dioxo-purin-9-ium-5-id-1-yl)acetic acid
Molecular Mass 239.208 g·mol−1
Heat of Formation -551.2 ± 16.7 kJ·mol−1
Dipole Moment 5.25 ± 1.08 D
Volume 257.77 Å 3
Surface Area 237.28 Å 2
HOMO Energy -9.13 ± 0.55 eV
LUMO Energy -0.92 ± eV
Point Group Symmetry C1
InChIKey ZBOTUVXDYKSUQW-UHFFFAOYSA-P
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