1-Ethyl-6-Fluoro-7-{4-[(4-Methyl-5-Methylene-2-Oxo-1,3-Dioxolan-4-Yl)Oxy]-1-Piperazinyl}-4-Oxo-1,4-Dihydro-3-Quinolinecarboxylic Acid

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Properties Simple | Detailed

Formula C21H22FN3O7
IUPAC Name 1-ethyl-6-fluoro-7-[4-[[(4r)-4-methyl-5-methylene-2-oxo-1,3-dioxolan-4-yl]oxy]piperazin-1-yl]-4-oxo-quinolin-1-ium-3-ide-3-carboxylic acid
Molecular Mass 447.414 g·mol−1
Heat of Formation 2214.3 ± 16.7 kJ·mol−1
Dipole Moment 9.12 ± 1.08 D
Volume 464.38 Å 3
Surface Area 431.5 Å 2
HOMO Energy -8.46 ± 0.55 eV
LUMO Energy -2.39 ± eV
Point Group Symmetry C1
InChIKey ZBDVTPRXALZLIJ-OAQYLSRUSA-N
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