(1S,5S,6R)-10-[(3,5-Dichlorophenyl)Sulfonyl]-5-[(1R)-1,2-Dihydroxyethyl]-3-[2-(3,4-Dimethoxyphenoxy)Ethyl]-3,10-Diazabicyclo[4.3.1]Decan-2-One
Properties
| Property | Value |
|---|---|
| Formula | C26H32Cl2N2O8S |
| IUPAC Name | (1s,5s,6r)-10-(3,5-dichlorophenyl)sulfonyl-5-[(1r)-1,2-dihydroxyethyl]-3-[2-(3,4-dimethoxyphenoxy)ethyl]-3,10-diazabicyclo[4.3.1]decan-2-one |
| Molecular Mass | 603.512 g·mol−1 |
| Heat of Formation | -1241.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.49 ± 1.08 D |
| Volume | 650.38 Å 3 |
| Surface Area | 475.89 Å 2 |
| HOMO Energy | -8.50 ± 0.55 eV |
| LUMO Energy | -0.79 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | JKYLGBPUGDRSCP-BJESRGMDSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C Cl H O N S |