(3R)-3-(2,4-Difluorophenyl)-2,2-Difluoro-3-Hydroxy-4-(1H-1,2,4-Triazol-1-Yl)Butanamide
Properties
Property | Value |
---|---|
Formula | C12H10F4N4O2 |
IUPAC Name | (3s)-3-(2,4-difluorophenyl)-2,2-difluoro-3-hydroxy-4-(1,2,4-triazol-1-yl)butanamide |
Molecular Mass | 318.227 g·mol−1 |
Heat of Formation | -876.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.98 ± 1.08 D |
Volume | 324.26 Å 3 |
Surface Area | 266.67 Å 2 |
HOMO Energy | -10.45 ± 0.55 eV |
LUMO Energy | -0.95 ± eV |
Point Group Symmetry | C1 |
InChIKey | KDHNDVXHMRYACP-LLVKDONJSA-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 |