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

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Properties Simple | Detailed

Formula C16H23N4O2
IUPAC Name 8-(dicyclopropylmethyl)-1-methyl-3-propyl-7h-purin-9-ium-5-ide-2,6-dione
Molecular Mass 303.379 g·mol−1
Heat of Formation -122.0 ± 16.7 kJ·mol−1
Dipole Moment 4.00 ± 1.08 D
Volume 380.07 Å 3
Surface Area 336.08 Å 2
HOMO Energy -8.95 ± 0.55 eV
LUMO Energy 2.61 ± eV
Point Group Symmetry C1
InChIKey VNUHGWXCBFTZFT-UHFFFAOYSA-P
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