N-[(8α)-2-Chloro-6-Methylergolin-8-Yl]-2,2-Dimethylpropanamide
Properties
Property | Value |
---|---|
Formula | C20H26ClN3O |
IUPAC Name | n-[(6ar,7r,9s,10ar)-5-chloro-7-methyl-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-4-ium-9-yl]-2,2-dimethyl-propanamide |
Molecular Mass | 359.893 g·mol−1 |
Heat of Formation | -139.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.37 ± 1.08 D |
Volume | 435.15 Å 3 |
Surface Area | 363.44 Å 2 |
HOMO Energy | -8.54 ± 0.55 eV |
LUMO Energy | -0.22 ± eV |
Point Group Symmetry | C1 |
Synonyms |
|
CAS Number(s) |
|
InChIKey | QXOFQMUQMXGKGQ-NORZTCDRSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C N O Cl |