Formula |
C17H18F3N3O4 |
IUPAC Name |
(1r)-6,8-difluoro-1-(2-fluoroethyl)-7-(4-methylpiperazin-1-yl)-1-oxido-4-oxo-quinolin-1-ium-3-carboxylic acid |
Molecular Mass |
385.338 g·mol−1 |
Heat of Formation |
1411.6 ± 16.7 kJ·mol−1 |
Dipole Moment |
7.99 ± 1.08 D |
Volume |
340.59 Å 3 |
Surface Area |
287.95 Å 2 |
HOMO Energy |
-9.30 ± 0.55 eV |
LUMO Energy |
-0.95 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
KVNDGTMEVBXOCL-HSZRJFAPSA-N |
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Elements |
C
F
O
N
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