Refosporin[Sodium-7-[3,5-Dichloro-4-Dihydropyridylacetylamino]-3-[[(5-Methyl-1,3,4-Thiadiazolyl)-Thio]Methyl]-3-Cephem-4-Carboxylate]
Properties
| Property | Value |
|---|---|
| Formula | C18H19Cl2N5O5S3 |
| IUPAC Name | 7-[[2-(3,5-dichloro-4-oxo-1-piperidyl)acetyl]amino]-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid |
| Molecular Mass | 552.475 g·mol−1 |
| Heat of Formation | -356.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.37 ± 1.08 D |
| Volume | 561.84 Å 3 |
| Surface Area | 462.01 Å 2 |
| HOMO Energy | -8.99 ± 0.55 eV |
| LUMO Energy | -1.42 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | DBMDBAPIBRTYIU-ZJSSQKTOSA-O |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C Cl H O N S |