1-Cyclopropyl-7-[(1R,3R)-3-Ethylpiperazin-1-Yl]-6-Fluoro-8-Methoxy-4-Oxo-2,5-Dihydroquinoline-2,3,4A,5,6,7,8,8A-Octaide-3-Carboxylic Acid
Properties
| Property | Value |
|---|---|
| Formula | C20H33FN3O4+ |
| IUPAC Name | (1s,3s,4as,6s,7r,8s,8as)-1-cyclopropyl-7-[(1r,3r)-3-ethylpiperazin-1-yl]-6-fluoro-8-methoxy-4-oxo-2,3,4a,5,6,7,8,8a-octahydro-1h-quinolin-1-ium-3-carboxylic acid |
| Molecular Mass | 398.492 g·mol−1 |
| Heat of Formation | -597.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.74 ± 1.08 D |
| Volume | 450.41 Å 3 |
| Surface Area | 375.29 Å 2 |
| HOMO Energy | -8.84 ± 0.55 eV |
| LUMO Energy | 2.06 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | NLWBROPVPNHCOM-RVMSCHOESA-O |
| QR Code | Generate QR Code |
| Links | |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C N O F |