1-Cyclopropyl-8-(Difluoromethoxy)-6-Fluoro-7-[(1S,3S)-3-Methylpiperazin-1-Yl]-4-Oxo-2,5-Dihydroquinoline-2,3,4A,5,6,7,8,8A-Octaide-3-Carboxylic Acid
Properties
| Property | Value |
|---|---|
| Formula | C19H29F3N3O4+ |
| IUPAC Name | (1s,3s,4as,6s,7s,8s,8as)-1-cyclopropyl-8-(difluoromethoxy)-6-fluoro-7-[(1s,3s)-3-methylpiperazin-1-yl]-4-oxo-2,3,4a,5,6,7,8,8a-octahydro-1h-quinolin-1-ium-3-carboxylic acid |
| Molecular Mass | 420.446 g·mol−1 |
| Heat of Formation | -1005.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.62 ± 1.08 D |
| Volume | 445.81 Å 3 |
| Surface Area | 366.24 Å 2 |
| HOMO Energy | -9.09 ± 0.55 eV |
| LUMO Energy | 1.88 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | NBUDTONJNPSNII-PRPDILJHSA-O |
| QR Code | Generate QR Code |
| Links | |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C N O F |