3-[9-Methoxy-3-(2-Phenylethyl)-3-Azabicyclo[3.3.1]Non-9-Yl]Phenyl Benzoate
Properties
| Property | Value |
|---|---|
| Formula | C30H33NO3 |
| IUPAC Name | [3-[(1s,5r)-9-methoxy-3-(2-phenylethyl)-3-azabicyclo[3.3.1]nonan-9-yl]phenyl] benzoate |
| Molecular Mass | 455.588 g·mol−1 |
| Heat of Formation | -237.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.64 ± 1.08 D |
| Volume | 562.58 Å 3 |
| Surface Area | 468.39 Å 2 |
| HOMO Energy | -8.37 ± 0.55 eV |
| LUMO Energy | 2.26 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | MRRYQQLLKOIYES-DQCWTMQVSA-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 |