(3R,4S)-3-Hydroxy-4-(4-Methoxyphenyl)-6-(Trifluoromethyl)-1,3,4,5-Tetrahydro-2H-1-Benzazepin-2-One
Properties
| Property | Value |
|---|---|
| Formula | C18H16F3NO3 |
| IUPAC Name | (3s,4r)-3-hydroxy-4-(4-methoxyphenyl)-6-(trifluoromethyl)-1,3,4,5-tetrahydro-1-benzazepin-2-one |
| Molecular Mass | 351.320 g·mol−1 |
| Heat of Formation | -1009.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.33 ± 1.08 D |
| Volume | 379.06 Å 3 |
| Surface Area | 322.13 Å 2 |
| HOMO Energy | -9.03 ± 0.55 eV |
| LUMO Energy | 1.96 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | ONMIAHGWZCQYQB-WBMJQRKESA-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 |