4-(4-Fluorobenzyl)-2-[1-(2-Phenylethyl)-4-Azepanyl]-1(2H)-Phthalazinone
Properties
| Property | Value |
|---|---|
| Formula | C29H30FN3O |
| IUPAC Name | 4-[(4-fluorophenyl)methyl]-2-[(4r)-1-(2-phenylethyl)azepan-4-yl]phthalazin-1-one |
| Molecular Mass | 455.566 g·mol−1 |
| Heat of Formation | 8.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.30 ± 1.08 D |
| Volume | 569.32 Å 3 |
| Surface Area | 441.62 Å 2 |
| HOMO Energy | -8.51 ± 0.55 eV |
| LUMO Energy | 2.24 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | HQFSNUYUXXPVKL-RUZDIDTESA-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 |