1,3-Diallyl-8-Cyclohexyl-7H-Purin-9-Ium-5-Ide-2,6-Dione

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Formula C17H22N4O2
IUPAC Name 1,3-diallyl-8-cyclohexyl-7h-purin-9-ium-5-ide-2,6-dione
Molecular Mass 314.382 g·mol−1
Heat of Formation -149.4 ± 16.7 kJ·mol−1
Dipole Moment 4.39 ± 1.08 D
Volume 390.92 Å 3
Surface Area 343.51 Å 2
HOMO Energy -8.98 ± 0.55 eV
LUMO Energy 2.59 ± eV
Point Group Symmetry C1
InChIKey DEOFHQDLFFCYBV-UHFFFAOYSA-P
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