(2S)-1-[(3Ar,4S,7Ar)-4-Hydroxy-4-(2-Methoxyphenyl)-7,7-Diphenyloctahydro-2H-Isoindol-2-Yl]-2-(2-Methoxyphenyl)-1-Propanone
Properties
| Property | Value |
|---|---|
| Formula | C37H39NO4 |
| IUPAC Name | (2s)-1-[(3as,4s,7as)-4-hydroxy-4-(2-methoxyphenyl)-7,7-diphenyl-1,3,3a,5,6,7a-hexahydroisoindol-2-yl]-2-(2-methoxyphenyl)propan-1-one |
| Molecular Mass | 561.710 g·mol−1 |
| Heat of Formation | -391.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.47 ± 1.08 D |
| Volume | 686.33 Å 3 |
| Surface Area | 492.22 Å 2 |
| HOMO Energy | -8.55 ± 0.55 eV |
| LUMO Energy | -0.23 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | CCIWVEMVBWEMCY-CTMXYHARSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |