7-[(1S,3S,5S)-3-Amino-5-Methyl-1-Piperidyl]-1-Cyclopropyl-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 | C20H34N3O4+ |
| IUPAC Name | (1r,3r,4ar,7s,8r,8ar)-7-[(1s,3s,5s)-3-amino-5-methyl-1-piperidyl]-1-cyclopropyl-8-methoxy-4-oxo-2,3,4a,5,6,7,8,8a-octahydro-1h-quinolin-1-ium-3-carboxylic acid |
| Molecular Mass | 380.502 g·mol−1 |
| Heat of Formation | -446.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.19 ± 1.08 D |
| Volume | 443.1 Å 3 |
| Surface Area | 363.1 Å 2 |
| HOMO Energy | -8.87 ± 0.55 eV |
| LUMO Energy | 2.22 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | CHFQRXPYUSJAFM-MEODREILSA-O |
| QR Code | Generate QR Code |
| Links | |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |