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

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Formula C17H20N4O5S
IUPAC Name 1,3-dipropyl-8-(4-sulfophenyl)-7h-purin-9-ium-5-ide-2,6-dione
Molecular Mass 392.430 g·mol−1
Heat of Formation -712.2 ± 16.7 kJ·mol−1
Dipole Moment 0.88 ± 1.08 D
Volume 437.44 Å 3
Surface Area 390.11 Å 2
HOMO Energy -9.19 ± 0.55 eV
LUMO Energy 2.43 ± eV
Point Group Symmetry C1
InChIKey DCIQIKXQJCKBBH-UHFFFAOYSA-P
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