Ethyl {4-[3-(2,4-Dihydroxy-5-Isopropylphenyl)-5-Sulfanyl-4H-1,2,4-Triazol-4-Yl]Benzyl}Carbamate
Properties
| Property | Value |
|---|---|
| Formula | C21H24N4O4S |
| IUPAC Name | ethyl {4-[3-(2,4-dihydroxy-5-isopropylphenyl)-5-sulfanyl-4h-1,2,4-triazol-4-yl]benzyl}carbamate |
| Molecular Mass | 428.505 g·mol−1 |
| Heat of Formation | -455.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.62 ± 1.08 D |
| Volume | 504.38 Å 3 |
| Surface Area | 411.77 Å 2 |
| HOMO Energy | -8.69 ± 0.55 eV |
| LUMO Energy | -1.33 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | VVLULBZUIUWMQM-UHFFFAOYSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C S O N |