1-Cyclopentyl-3-Pyrrolo[2,3-B]Pyridin-7-Ium-5-Id-5-Yl-Pyrazolo[3,4-D]Pyrimidine-5,7-Diium-3A-Id-4-Amine

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Formula C17H19N7
IUPAC Name 1-cyclopentyl-3-pyrrolo[2,3-b]pyridin-7-ium-5-id-5-yl-pyrazolo[3,4-d]pyrimidine-5,7-diium-3a-id-4-amine
Molecular Mass 321.380 g·mol−1
Heat of Formation 482.4 ± 16.7 kJ·mol−1
Dipole Moment 3.63 ± 1.08 D
Volume 370.55 Å 3
Surface Area 330.89 Å 2
HOMO Energy -8.78 ± 0.55 eV
LUMO Energy 1.32 ± eV
Point Group Symmetry C1
InChIKey YJFTYJLLNLJSAY-UHFFFAOYSA-P
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Elements H C N