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

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Formula C25H35N3O
IUPAC Name (6as,7s,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 -179.0 ± 16.7 kJ·mol−1
Dipole Moment 4.09 ± 1.08 D
Volume 507.3 Å 3
Surface Area 421.67 Å 2
HOMO Energy -8.04 ± 0.55 eV
LUMO Energy 0.18 ± eV
Point Group Symmetry C1
InChIKey KEMOOQHMCGCZKH-AAIMPIBUSA-N
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