4-(4-(4-Chlorophenyl)-4-Hydroxyazepan-1-Yl)-1-(4-Fluorophenyl)Butan-1-One
Properties
| Property | Value |
|---|---|
| Formula | C22H25ClFNO2 |
| IUPAC Name | 4-[(4r)-4-(4-chlorophenyl)-4-hydroxy-azepan-1-yl]-1-(4-fluorophenyl)butan-1-one |
| Molecular Mass | 389.891 g·mol−1 |
| Heat of Formation | -450.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.16 ± 1.08 D |
| Volume | 463.7 Å 3 |
| Surface Area | 359.24 Å 2 |
| HOMO Energy | -8.97 ± 0.55 eV |
| LUMO Energy | 2.25 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | JJXYNELAGRWXFC-JOCHJYFZSA-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 |