8-(3,4-Dimethoxyphenyl)-7-Methyl-1,3-Dipropyl-Purin-9-Ium-5-Ide-2,6-Dione

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Formula C20H27N4O4
IUPAC Name 8-(3,4-dimethoxyphenyl)-7-methyl-1,3-dipropyl-purin-9-ium-5-ide-2,6-dione
Molecular Mass 387.453 g·mol−1
Heat of Formation -502.4 ± 16.7 kJ·mol−1
Dipole Moment 5.04 ± 1.08 D
Volume 468.35 Å 3
Surface Area 410.92 Å 2
HOMO Energy -8.79 ± 0.55 eV
LUMO Energy 2.45 ± eV
Point Group Symmetry C1
InChIKey QPEQKVOJZIKUCN-UHFFFAOYSA-P
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