(1S,2R,3S,4R,6R,7R,8R,14R)-4-Ethyl-3-Hydroxy-2,4,7,14-Tetramethyl-9-Oxotricyclo[5.4.3.0~1,8~]Tetradec-6-Yl [(5-Amino-1H-1,2,4-Triazol-3-Yl)Sulfanyl]Acetate
Properties
| Property | Value |
|---|---|
| Formula | C24H38N4O4S |
| IUPAC Name | 4-ethyl-3-hydroxy-2,4,7,14-tetramethyl-9-oxotricyclo[5.4.3.0 1,8 ]tetradec-6-yl [(3-amino-1h-1,2,4-triazol-5-yl)sulfanyl]acetate |
| Molecular Mass | 478.648 g·mol−1 |
| Heat of Formation | -708.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.84 ± 1.08 D |
| Volume | 576.73 Å 3 |
| Surface Area | 398.4 Å 2 |
| HOMO Energy | -8.61 ± 0.55 eV |
| LUMO Energy | -0.31 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | FMHQJXGMLMSMLC-OHCLEQHUSA-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 |