1-Methyl-3,7-Dihydropurin-9-Ium-5-Ide-2,6-Dione

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Formula C6H7N4O2
IUPAC Name 1-methyl-3,7-dihydropurin-9-ium-5-ide-2,6-dione
Molecular Mass 167.145 g·mol−1
Heat of Formation -181.4 ± 16.7 kJ·mol−1
Dipole Moment 3.40 ± 1.08 D
Volume 175.22 Å 3
Surface Area 175.56 Å 2
HOMO Energy -9.50 ± 0.55 eV
LUMO Energy 2.23 ± eV
Point Group Symmetry C1
InChIKey WFMTXDMECVMTEX-UHFFFAOYSA-P
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