Methyl 8-Methylene-3-{[(5-Methyl-1,3,4-Thiadiazol-2-Yl)Sulfanyl]Methyl}-7-[(1H-Tetrazol-1-Ylacetyl)Amino]-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylate
Properties
| Property | Value |
|---|---|
| Formula | C16H18N8O3S3 |
| IUPAC Name | methyl (6r,7r)-8-methylene-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-7-[[2-(tetrazol-1-yl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate |
| Molecular Mass | 466.561 g·mol−1 |
| Heat of Formation | 276.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 9.65 ± 1.08 D |
| Volume | 507.27 Å 3 |
| Surface Area | 424.81 Å 2 |
| HOMO Energy | -8.97 ± 0.55 eV |
| LUMO Energy | -1.46 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | AODDZVXSRQMZGM-TZMCWYRMSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H S C O N |