N-{(3R,4R)-1-[2-(4-Isothiocyanatophenyl)Ethyl]-3-Methyl-4-Piperidinyl}-N-Phenylpropanamide
Properties
| Property | Value |
|---|---|
| Formula | C24H29N3OS |
| IUPAC Name | n-[(1r,3r,4r)-1-[2-(4-isothiocyanatophenyl)ethyl]-3-methyl-4-piperidyl]-n-phenyl-propanamide |
| Molecular Mass | 407.572 g·mol−1 |
| Heat of Formation | 83.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.71 ± 1.08 D |
| Volume | 512.13 Å 3 |
| Surface Area | 446.6 Å 2 |
| HOMO Energy | -8.60 ± 0.55 eV |
| LUMO Energy | -0.92 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | ZQESQBVNDBLWAM-AUSIDOKSSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H S C O N |