(2S,5R,6R,7R)-6-{[(2R)-2-Carboxy-2-Phenylacetyl]Amino}-7-Hydroxy-3,3-Dimethyl-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylic Acid
Properties
| Property | Value |
|---|---|
| Formula | C17H20N2O6S |
| IUPAC Name | (1s,2s,5r,6r,7r)-6-[[(2r)-2-carboxy-2-phenyl-acetyl]amino]-7-hydroxy-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid |
| Molecular Mass | 380.416 g·mol−1 |
| Heat of Formation | -951.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.46 ± 1.08 D |
| Volume | 427.1 Å 3 |
| Surface Area | 354.69 Å 2 |
| HOMO Energy | -9.04 ± 0.55 eV |
| LUMO Energy | 2.45 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | ASNJKAXIMWOZDG-KHQUWSPVSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C S O N |