5-(5-Fluoro-2-Methylphenyl)-6,7,8,9-Tetrahydro-3H-Pyrazolo[3,4-C]Isoquinolin-1-Amine

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Formula C17H17FN4
IUPAC Name 5-(5-fluoro-2-methyl-phenyl)-6,7,8,9-tetrahydropyrazolo[3,4-c]isoquinolin-3-ium-9b-id-1-amine
Molecular Mass 296.342 g·mol−1
Heat of Formation 104.0 ± 16.7 kJ·mol−1
Dipole Moment 4.94 ± 1.08 D
Volume 346.86 Å 3
Surface Area 301.28 Å 2
HOMO Energy -8.48 ± 0.55 eV
LUMO Energy 2.48 ± eV
Point Group Symmetry C1
InChIKey YPULTKAHHAYKOE-UHFFFAOYSA-N
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Elements H C F N