(3β,8β)-6,8-Dimethyl-9,10-Didehydro-2,3-Dihydroergoline
Properties
Property | Value |
---|---|
Formula | C16H20N2 |
IUPAC Name | (5as,6ar,7s,9r)-7,9-dimethyl-5,5a,6,6a,8,9-hexahydro-4h-indolo[4,3-fg]quinoline |
Molecular Mass | 240.343 g·mol−1 |
Heat of Formation | 178.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.35 ± 1.08 D |
Volume | 304.91 Å 3 |
Surface Area | 265.98 Å 2 |
HOMO Energy | -8.29 ± 0.55 eV |
LUMO Energy | 3.02 ± eV |
Point Group Symmetry | C1 |
InChIKey | OJCJIVYNZFHBOS-UEKVPHQBSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C N |