1-Ethyl-6,8-Difluoro-7-[(1R,3R)-3-Methylpiperazin-1-Yl]-4-Oxo-2,5-Dihydroquinoline-2,3,4A,5,6,7,8,8A-Octaide-3-Carboxylic Acid

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Properties Simple | Detailed

Formula C17H28F2N3O3+
IUPAC Name 1-ethyl-6,8-difluoro-7-[(1r,3r)-3-methylpiperazin-1-yl]-4-oxo-2,5-dihydroquinoline-2,3,4a,5,6,7,8,8a-octaide-3-carboxylic acid
Molecular Mass 360.419 g·mol−1
Heat of Formation -716.4 ± 16.7 kJ·mol−1
Dipole Moment 5.34 ± 1.08 D
Volume 392.35 Å 3
Surface Area 339.76 Å 2
HOMO Energy -8.97 ± 0.55 eV
LUMO Energy 1.88 ± eV
Point Group Symmetry C1
InChIKey QXRODIAZDWBDJD-FCKCIMNISA-O
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