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

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Properties Simple | Detailed

Formula C19H31F2N4O3+
IUPAC Name 5-amino-1-cyclopropyl-7-[(3r,5s)-3,5-dimethylpiperazin-1-yl]-6,8-difluoro-4-oxo-2h-quinoline-2,3,4a,5,6,7,8,8a-octaide-3-carboxylic acid
Molecular Mass 401.471 g·mol−1
Heat of Formation -654.8 ± 16.7 kJ·mol−1
Dipole Moment 5.61 ± 1.08 D
Volume 436.72 Å 3
Surface Area 369.7 Å 2
HOMO Energy -8.46 ± 0.55 eV
LUMO Energy 2.14 ± eV
Point Group Symmetry C1
InChIKey WCAGOAAMDSDZLM-JHSJVTLWSA-O
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