7-[(1S,3R)-3-(1-Aminocyclopropyl)Pyrrolidin-1-Yl]-1-[(1R,2S)-2-Fluorocyclopropyl]-8-Methoxy-4-Oxo-5,6-Dihydro-2H-Quinoline-2,3,4A,5,6,7,8,8A-Octaide-3-Carboxylic Acid
Properties
| Property | Value |
|---|---|
| Formula | C21H33FN3O4+ |
| IUPAC Name | (1r,3s,4as,7s,8s,8as)-7-[(1s,3r)-3-(1-aminocyclopropyl)pyrrolidin-1-yl]-1-[(1r,2s)-2-fluorocyclopropyl]-8-methoxy-4-oxo-2,3,4a,5,6,7,8,8a-octahydro-1h-quinolin-1-ium-3-carboxylic acid |
| Molecular Mass | 410.503 g·mol−1 |
| Heat of Formation | -484.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 12.49 ± 1.08 D |
| Volume | 465.56 Å 3 |
| Surface Area | 382.51 Å 2 |
| HOMO Energy | -8.21 ± 0.55 eV |
| LUMO Energy | 2.52 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | IDGVJCRMXSLOID-QPOMACMGSA-O |
| QR Code | Generate QR Code |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C N O F |