5-{1-[2-(1H-Imidazol-4-Yl)Ethyl]-2-Oxo-2,5-Dihydro-1H-Pyrrol-3-Yl}-2-{2-[(2S,4Ar)-1,2,5,5-Tetramethyl-1,2,3,4,4A,5,6,7-Octahydro-1-Naphthalenyl]Ethyl}Pentyl Hydrogen Sulfate
Properties
| Property | Value |
|---|---|
| Formula | C30H47N3O5S |
| IUPAC Name | [(2r)-2-[2-[(1s,2s,4ar)-1,2,5,5-tetramethyl-2,3,4,4a,6,7-hexahydronaphthalen-1-yl]ethyl]-5-[1-[2-(1h-imidazol-5-yl)ethyl]-5-oxo-2h-pyrrol-4-yl]pentyl] hydrogen sulfate |
| Molecular Mass | 561.776 g·mol−1 |
| Heat of Formation | -981.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.62 ± 1.08 D |
| Volume | 701.92 Å 3 |
| Surface Area | 482.39 Å 2 |
| HOMO Energy | -8.76 ± 0.55 eV |
| LUMO Energy | -0.32 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | IAJOBCOCHZRJMA-CSYFSRKCSA-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 |