6-Benzyl-1-Isopropyl-Pyrazolo[3,4-D]Pyrimidine-1,2,5,7-Tetraium-4-One

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Formula C15H16N4O
IUPAC Name 6-benzyl-1-isopropyl-pyrazolo[3,4-d]pyrimidine-1,2,5,7-tetraium-4-one
Molecular Mass 268.314 g·mol−1
Heat of Formation 229.1 ± 16.7 kJ·mol−1
Dipole Moment 8.25 ± 1.08 D
Volume 329.82 Å 3
Surface Area 282.52 Å 2
HOMO Energy -9.23 ± 0.55 eV
LUMO Energy -1.58 ± eV
Point Group Symmetry C1
InChIKey GWDRTNMONAWPRZ-UHFFFAOYSA-O
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