(1R)-1-(2-Fluorophenyl)-1-(4-Fluorophenyl)-2-(1H-1,2,4-Triazol-1-Yl)Ethanol

Molecule SVG Image

Properties Simple | Detailed

Formula C16H13F2N3O
IUPAC Name (1r)-2-(4-aza-1-azonia-2-azanidacyclopenta-3,5-dien-1-yl)-1-(2-fluorophenyl)-1-(4-fluorophenyl)ethanol
Molecular Mass 301.291 g·mol−1
Heat of Formation -156.1 ± 16.7 kJ·mol−1
Dipole Moment 3.25 ± 1.08 D
Volume 341.72 Å 3
Surface Area 287.62 Å 2
HOMO Energy -9.79 ± 0.55 eV
LUMO Energy -0.61 ± eV
Point Group Symmetry C1
InChIKey JWUCHKBSVLQQCO-MRXNPFEDSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C N O F