4-[(5R)-5-(3,5-Dichlorophenyl)-5-(Trifluoromethyl)-4,5-Dihydro-1,2-Oxazol-3-Yl]-2-Methyl-N-{2-Oxo-2-[(2,2,2-Trifluoroethyl)Amino]Ethyl}Benzamide
Properties
Property | Value |
---|---|
Formula | C22H17Cl2F6N3O3 |
IUPAC Name | 4-[(5r)-5-(3,5-dichlorophenyl)-5-(trifluoromethyl)-4h-isoxazol-3-yl]-2-methyl-n-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]benzamide |
Molecular Mass | 556.285 g·mol−1 |
Heat of Formation | -1603.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.83 ± 1.08 D |
Volume | 562.2 Å 3 |
Surface Area | 469.62 Å 2 |
HOMO Energy | -9.98 ± 0.55 eV |
LUMO Energy | 1.68 ± eV |
Point Group Symmetry | C1 |
InChIKey | MLBZKOGAMRTSKP-HXUWFJFHSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | C F H Cl O N |