3-(2-Benzyloxy-8-Methyl-Quinolin-1-Ium-4A-Id-6-Yl)-1-Isopropyl-Pyrazolo[3,4-D]Pyrimidine-5,7-Diium-3A-Id-4-Amine

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Properties Simple | Detailed

Formula C25H26N6O
IUPAC Name 3-(2-benzyloxy-8-methyl-quinolin-1-ium-4a-id-6-yl)-1-isopropyl-pyrazolo[3,4-d]pyrimidine-5,7-diium-3a-id-4-amine
Molecular Mass 426.514 g·mol−1
Heat of Formation 346.6 ± 16.7 kJ·mol−1
Dipole Moment 2.74 ± 1.08 D
Volume 509.77 Å 3
Surface Area 445.92 Å 2
HOMO Energy -8.76 ± 0.55 eV
LUMO Energy 2.12 ± eV
Point Group Symmetry C1
InChIKey SYXOKTMXFIHCMA-UHFFFAOYSA-O
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