(2S)-1,1,1-Trifluoro-2-[4-(1H-Pyrazol-1-Yl)Phenyl]-3-(4-{[1-(Trifluoromethyl)Cyclopropyl]Methyl}-1H-Imidazol-2-Yl)-2-Propanol
Properties
| Property | Value |
|---|---|
| Formula | C20H18F6N4O |
| IUPAC Name | (2s)-1,1,1-trifluoro-2-(4-pyrazol-1-ium-2-id-1-ylphenyl)-3-[5-[[1-(trifluoromethyl)cyclopropyl]methyl]-4h-imidazole-4,5-diylium-2-yl]propan-2-ol |
| Molecular Mass | 444.374 g·mol−1 |
| Heat of Formation | -1082.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 8.82 ± 1.08 D |
| Volume | 475.38 Å 3 |
| Surface Area | 360.11 Å 2 |
| HOMO Energy | -9.02 ± 0.55 eV |
| LUMO Energy | -0.64 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | UJINBEQCDMOAHM-SFHVURJKSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C N O F |