3-Methyl-1-(5-Oxohexyl)-7-Propyl-Purin-9-Ium-5-Ide-2,6-Dione

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Properties Simple | Detailed

Formula C15H23N4O3
IUPAC Name 3-methyl-1-(5-oxohexyl)-7-propyl-purin-9-ium-5-ide-2,6-dione
Molecular Mass 307.368 g·mol−1
Heat of Formation -492.8 ± 16.7 kJ·mol−1
Dipole Moment 5.44 ± 1.08 D
Volume 376.68 Å 3
Surface Area 343.9 Å 2
HOMO Energy -8.94 ± 0.55 eV
LUMO Energy 2.56 ± eV
Point Group Symmetry C1
InChIKey PWUDSOCJBBUSFG-UHFFFAOYSA-P
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