2-Amino-8-Methyl-3,7-Dihydropurine-1,9-Diium-5-Id-6-One

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Formula C6H8N5O
IUPAC Name 2-amino-8-methyl-3,7-dihydropurine-1,9-diium-5-id-6-one
Molecular Mass 166.161 g·mol−1
Heat of Formation 57.2 ± 16.7 kJ·mol−1
Dipole Moment 4.56 ± 1.08 D
Volume 179.92 Å 3
Surface Area 184.16 Å 2
HOMO Energy -9.12 ± 0.55 eV
LUMO Energy 2.68 ± eV
Point Group Symmetry C1
InChIKey WXTLCUCBYQGXCL-UHFFFAOYSA-O
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