2-Chloro-N-{(3S)-1-[(2R)-2,3-Dihydroxypropyl]-2-Oxo-1,2,3,4-Tetrahydro-3-Quinolinyl}-6H-Thieno[2,3-B]Pyrrole-5-Carboxamide
Properties
| Property | Value |
|---|---|
| Formula | C19H18ClN3O4S |
| IUPAC Name | 2-chloro-n-[(3s)-1-[(2r)-2,3-dihydroxypropyl]-2-oxo-3,4-dihydroquinolin-3-yl]thieno[2,3-b]pyrrole-1,6-diium-5-carboxamide |
| Molecular Mass | 419.882 g·mol−1 |
| Heat of Formation | -450.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.49 ± 1.08 D |
| Volume | 454.55 Å 3 |
| Surface Area | 400.14 Å 2 |
| HOMO Energy | -8.92 ± 0.55 eV |
| LUMO Energy | -1.15 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | UICNBXVDHCBKCE-OCCSQVGLSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C Cl H O N S |