1-Cyclopropyl-7-[(3S,5R)-3,5-Dimethylpiperazin-1-Yl]-5,6,8-Trifluoro-4-Oxo-2H-Quinoline-2,3,4A,5,6,7,8,8A-Octaide-3-Carboxylic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C19H29F3N3O3+
IUPAC Name 1-cyclopropyl-7-[(3s,5r)-3,5-dimethylpiperazin-1-yl]-5,6,8-trifluoro-4-oxo-2h-quinoline-2,3,4a,5,6,7,8,8a-octaide-3-carboxylic acid
Molecular Mass 404.447 g·mol−1
Heat of Formation -793.9 ± 16.7 kJ·mol−1
Dipole Moment 8.60 ± 1.08 D
Volume 432.47 Å 3
Surface Area 368.96 Å 2
HOMO Energy -9.03 ± 0.55 eV
LUMO Energy 1.80 ± eV
Point Group Symmetry C1
InChIKey LEEGDHGFDSJJEN-JHSJVTLWSA-O
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C N O F