(8β,10Xi)-8-[(Methylsulfonyl)Methyl]-6-Propylergoline
Properties
| Property | Value |
|---|---|
| Formula | C19H26N2O2S |
| IUPAC Name | (6ar,9r,10ar)-9-(methylsulfonylmethyl)-7-propyl-6,6a,8,9,10,10a-hexahydro-4h-indolo[4,3-fg]quinoline |
| Molecular Mass | 346.487 g·mol−1 |
| Heat of Formation | -245.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.58 ± 1.08 D |
| Volume | 417.64 Å 3 |
| Surface Area | 350.53 Å 2 |
| HOMO Energy | -8.22 ± 0.55 eV |
| LUMO Energy | 0.13 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | BRFHHAXHZFOBNY-RPVQJOFSSA-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 |