4-[(1R,2R)-2-Hydroxycyclohexyl]-2-(Trifluoromethyl)Benzonitrile
Properties
Property | Value |
---|---|
Formula | C14H14F3NO |
IUPAC Name | 4-[(1r,2r)-2-hydroxycyclohexyl]-2-(trifluoromethyl)benzonitrile |
Molecular Mass | 269.262 g·mol−1 |
Heat of Formation | -718.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 8.23 ± 1.08 D |
Volume | 300.26 Å 3 |
Surface Area | 267.73 Å 2 |
HOMO Energy | -10.26 ± 0.55 eV |
LUMO Energy | -1.52 ± eV |
Point Group Symmetry | C1 |
InChIKey | MENRRRXHFQYXDW-DGCLKSJQSA-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 |