Costaclavin

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Formula C16H20N2
IUPAC Name (6ar,7r,9r,10as)-7,9-dimethyl-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-4-ium
Molecular Mass 240.343 g·mol−1
Heat of Formation 149.7 ± 16.7 kJ·mol−1
Dipole Moment 1.92 ± 1.08 D
Volume 304.63 Å 3
Surface Area 261.07 Å 2
HOMO Energy -8.04 ± 0.55 eV
LUMO Energy 0.35 ± eV
Point Group Symmetry C1
Synonyms
  • 6,8-dimethylergoline
  • costaclavine
  • epicostaclavin
  • ergoline, 6,8-dimethyl-, (8beta,10beta)-
  • pyroclavin
CAS Number(s)
  • 436-41-9
InChIKey VLMZMRDOMOGGFA-RIEGTJTDSA-N
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Elements H C N