8-Ethoxy-1,3,7-Trimethyl-Purin-9-Ium-5-Ide-2,6-Dione

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Formula C10H15N4O3
IUPAC Name 8-ethoxy-1,3,7-trimethyl-purin-9-ium-5-ide-2,6-dione
Molecular Mass 239.251 g·mol−1
Heat of Formation -382.3 ± 16.7 kJ·mol−1
Dipole Moment 4.86 ± 1.08 D
Volume 271.36 Å 3
Surface Area 257.52 Å 2
HOMO Energy -8.68 ± 0.55 eV
LUMO Energy 2.84 ± eV
Point Group Symmetry Cs
InChIKey PJLHVDWFWUQJMU-UHFFFAOYSA-P
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