1-(2,4-Difluorophenyl)-1-(3-{(E)-2-[4-(2,2,3,3-Tetrafluoropropoxy)Phenyl]Vinyl}-1H-1,2,4-Triazol-1-Yl)-2-(1H-1,2,4-Triazol-1-Yl)Ethanol
Properties
Property | Value |
---|---|
Formula | C23H18F6N6O2 |
IUPAC Name | 1-(2,4-difluorophenyl)-1-[3-[(e)-2-[4-(2,2,3,3-tetrafluoropropoxy)phenyl]ethenyl]-1,2,4-triazol-1-yl]-2-(1,2,4-triazol-1-yl)ethanol |
Molecular Mass | 524.418 g·mol−1 |
Heat of Formation | -857.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.12 ± 1.08 D |
Volume | 555.23 Å 3 |
Surface Area | 476.18 Å 2 |
HOMO Energy | -8.79 ± 0.55 eV |
LUMO Energy | 1.95 ± eV |
Point Group Symmetry | C1 |
InChIKey | RXORCNBQDTVJGM-DHXBXMGCSA-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 |