1-(5-Amino-2,4-Difluoro-Cyclohexyl)-6-Fluoro-8-Methyl-7-(Methylamino)-4-Oxo-2,5-Dihydroquinoline-2,3,4A,5,6,7,8,8A-Octaide-3-Carboxylic Acid
Properties
| Property | Value |
|---|---|
| Formula | C18H29F3N3O3+ |
| IUPAC Name | (1r,3s,4as,6r,7r,8r,8ar)-1-[(1s,2r,4s,5s)-5-amino-2,4-difluoro-cyclohexyl]-6-fluoro-8-methyl-7-(methylamino)-4-oxo-2,3,4a,5,6,7,8,8a-octahydro-1h-quinolin-1-ium-3-carboxylic acid |
| Molecular Mass | 392.436 g·mol−1 |
| Heat of Formation | -803.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 9.69 ± 1.08 D |
| Volume | 397.38 Å 3 |
| Surface Area | 339.98 Å 2 |
| HOMO Energy | -8.63 ± 0.55 eV |
| LUMO Energy | 1.83 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | JWPJUUMXPLBIAR-UHFFFAOYSA-O |
| QR Code | Generate QR Code |
| Links | |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C N O F |