[(8α,10Beta)-6-Methylergolin-8-Yl]Acetonitrile
Properties
Property | Value |
---|---|
Formula | C17H19N3 |
IUPAC Name | 2-[(6ar,9r,10as)-7-methyl-6,6a,8,9,10,10a-hexahydro-4h-indolo[4,3-fg]quinolin-9-yl]acetonitrile |
Molecular Mass | 265.353 g·mol−1 |
Heat of Formation | 258.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.12 ± 1.08 D |
Volume | 332.55 Å 3 |
Surface Area | 289.65 Å 2 |
HOMO Energy | -8.36 ± 0.55 eV |
LUMO Energy | -0.01 ± eV |
Point Group Symmetry | C1 |
InChIKey | LBMFWYCMCHRLBU-HZUKXOBISA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C N |