1-[3,5-Bis(Trifluoromethyl)Phenyl]-3-[5-Bromo-2-(1H-Tetrazol-5-Yl)Phenyl]Urea
Properties
| Property | Value |
|---|---|
| Formula | C16H9BrF6N6O |
| IUPAC Name | 1-[3,5-bis(trifluoromethyl)phenyl]-3-[5-bromo-2-(2h-tetrazol-5-yl)phenyl]urea |
| Molecular Mass | 495.177 g·mol−1 |
| Heat of Formation | -971.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 8.19 ± 1.08 D |
| Volume | 433.61 Å 3 |
| Surface Area | 395.08 Å 2 |
| HOMO Energy | -9.46 ± 0.55 eV |
| LUMO Energy | -1.48 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | OQRAKHDEGGGWQO-UHFFFAOYSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C F H O N Br |