5-{1-[2-(1H-Imidazol-4-Yl)Ethyl]-2,5-Dioxo-2,5-Dihydro-1H-Pyrrol-3-Yl}-2-[2-(1,2,5,5-Tetramethyl-1,2,3,4,4A,5,6,7-Octahydro-1-Naphthalenyl)Ethyl]Pentyl Hydrogen Sulfate
Properties
| Property | Value |
|---|---|
| Formula | C30H45N3O6S |
| IUPAC Name | [(2s)-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]-2,5-dioxo-pyrrol-3-yl]pentyl] hydrogen sulfate |
| Molecular Mass | 575.760 g·mol−1 |
| Heat of Formation | -1118.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.15 ± 1.08 D |
| Volume | 707.17 Å 3 |
| Surface Area | 479.55 Å 2 |
| HOMO Energy | -9.18 ± 0.55 eV |
| LUMO Energy | 1.66 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | KYSKWYJBCHWKSD-WNKWKMONSA-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 |