Ceratinadin A
Properties
| Property | Value |
|---|---|
| Formula | C24H21Br2N5O8 |
| IUPAC Name | (5s,6r)-7,9-dibromo-6-hydroxy-8-methoxy-n-[2-[3-(3,5,8-trihydroxy-4-oxo-2,7-dihydro-1h-quinoline-2,3,4a,5,6,7,8,8a-octaid-6-yl)-4h-imidazol-3-ium-4-ylium-5-yl]ethyl]-1-oxa-2-azaspiro[4.5]deca-2,7,9-triene-3-carboxamide |
| Molecular Mass | 667.260 g·mol−1 |
| Heat of Formation | -784.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 12.34 ± 1.08 D |
| Volume | 600.09 Å 3 |
| Surface Area | 420.61 Å 2 |
| HOMO Energy | -8.66 ± 0.55 eV |
| LUMO Energy | -1.54 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | ZWKWCDKTCUKSQC-LADGPHEKSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O Br N |