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

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Properties Simple | Detailed

Formula C16H24FN4O2
IUPAC Name 8-cyclopentyl-3-(3-fluoropropyl)-1-propyl-7h-purin-9-ium-5-ide-2,6-dione
Molecular Mass 323.386 g·mol−1
Heat of Formation -529.9 ± 16.7 kJ·mol−1
Dipole Moment 4.08 ± 1.08 D
Volume 390.05 Å 3
Surface Area 350.33 Å 2
HOMO Energy -9.07 ± 0.55 eV
LUMO Energy 2.50 ± eV
Point Group Symmetry C1
InChIKey HQAAMCCYBSJIPN-UHFFFAOYSA-P
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