(4R)-4-Cyclopropyl-7,8-Difluoro-5-{[4-(Trifluoromethyl)Phenyl]Sulfonyl}-4,5-Dihydro-2H-Pyrazolo[4,3-C]Quinoline

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Formula C20H14F5N3O2S
IUPAC Name (4r,5s)-4-cyclopropyl-7,8-difluoro-5-[4-(trifluoromethyl)phenyl]sulfonyl-4h-pyrazolo[4,3-c]quinolin-1-ium-2-ide
Molecular Mass 455.401 g·mol−1
Heat of Formation -882.1 ± 16.7 kJ·mol−1
Dipole Moment 1.59 ± 1.08 D
Volume 467.98 Å 3
Surface Area 357.09 Å 2
HOMO Energy -9.27 ± 0.55 eV
LUMO Energy -1.53 ± eV
Point Group Symmetry C1
InChIKey XODSHWXKSMPDRP-LJQANCHMSA-N
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