(8β)-6-Methyl-9,10-Didehydro-2,3-Dihydroergoline-8-Carboxamide
Properties
Property | Value |
---|---|
Formula | C16H19N3O |
IUPAC Name | (5as,6ar,9r)-7-methyl-5,5a,6,6a,8,9-hexahydro-4h-indolo[4,3-fg]quinoline-9-carboxamide |
Molecular Mass | 269.342 g·mol−1 |
Heat of Formation | 24.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.88 ± 1.08 D |
Volume | 324.39 Å 3 |
Surface Area | 285.97 Å 2 |
HOMO Energy | -8.33 ± 0.55 eV |
LUMO Energy | -0.10 ± eV |
Point Group Symmetry | C1 |
InChIKey | ITBOACXGWYGOHV-GPCCPHFNSA-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 |