2-Cyano-3-(6-Methylergolin-8B-Yl)Propionamide
Properties
Property | Value |
---|---|
Formula | C19H22N4O |
IUPAC Name | (2r)-3-[(6ar,9s,10ar)-7-methyl-6,6a,8,9,10,10a-hexahydro-4h-indolo[4,3-fg]quinolin-9-yl]-2-cyano-propanamide |
Molecular Mass | 322.404 g·mol−1 |
Heat of Formation | 85.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 8.34 ± 1.08 D |
Volume | 396.03 Å 3 |
Surface Area | 340.64 Å 2 |
HOMO Energy | -8.44 ± 0.55 eV |
LUMO Energy | -0.08 ± eV |
Point Group Symmetry | C1 |
InChIKey | LVMVXZOPCAMYHC-GADXADSLSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |