N-Cyclohexyl-1-Isopropyl-6-Methylergoline-8B-Carboxamide

Molecule SVG Image

Properties Simple | Detailed

Formula C25H35N3O
IUPAC Name (6ar,7r,9r,10ar)-n-cyclohexyl-4-isopropyl-7-methyl-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-4-ium-9-carboxamide
Molecular Mass 393.565 g·mol−1
Heat of Formation -164.0 ± 16.7 kJ·mol−1
Dipole Moment 3.94 ± 1.08 D
Volume 506.53 Å 3
Surface Area 419.98 Å 2
HOMO Energy -8.08 ± 0.55 eV
LUMO Energy 0.18 ± eV
Point Group Symmetry C1
Synonyms
  • amesergide (usan/inn)
  • d02893
InChIKey KEMOOQHMCGCZKH-JMUQELJHSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N