Harmine

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Properties Simple | Detailed

Formula C13H12N2O
IUPAC Name 7-methoxy-1-methyl-9h-pyrido[3,4-b]indole
Molecular Mass 212.247 g·mol−1
Heat of Formation 67.3 ± 16.7 kJ·mol−1
Dipole Moment 4.18 ± 1.08 D
Volume 252.62 Å 3
Surface Area 241.52 Å 2
HOMO Energy -8.54 ± 0.55 eV
LUMO Energy -0.73 ± eV
Point Group Symmetry Cs
Synonyms
  • 1-methyl-7-methoxy-beta-carboline
  • 343-27-1 (hcl)
  • 442-51-3 (free base)
  • 6-methoxyharman
  • 7-methoxy-1-methyl-9h-$b-carboline
  • 7-methoxy-1-methyl-9h-beta-carboline
  • 7-methoxy-1-methyl-9h-pyrido(3,4-b)indole
  • 7-methoxy-1-methyl-9h-pyrido[3,4-b]indole
  • 9h-pyrido(3,4-b)indole, 7-methoxy-1-methyl-
  • 9h-pyrido[3,4-b]indole, 7-methoxy-1-methyl-
  • acon1_000061
  • banisterine
  • bas 00654992
  • bpbio1_000602
  • megxp0_001875
  • oprea1_596686
  • sdccgmls-0066733.p001
  • telepathine
  • yageine
  • yajeine
CAS Number(s)
  • 442-51-3
InChIKey BXNJHAXVSOCGBA-UHFFFAOYSA-N
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