N-Methyl-9H-β-Carboline-3-Carboxamide

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Properties Simple | Detailed

Formula C13H11N3O
IUPAC Name n-methylpyrido[3,4-b]indol-9-ium-3-carboxamide
Molecular Mass 225.246 g·mol−1
Heat of Formation 97.3 ± 16.7 kJ·mol−1
Dipole Moment 4.71 ± 1.08 D
Volume 260.41 Å 3
Surface Area 250.41 Å 2
HOMO Energy -8.80 ± 0.55 eV
LUMO Energy -0.83 ± eV
Point Group Symmetry Cs
Synonyms
  • 9h-pyrido(3,4-b)indole-3-carboxamide, n-methyl-
  • beta-carboline-3-carboxylic acid n-methylamide
  • beta-cca methylamide
  • biomol-nt_000283
  • bpbio1_001102
  • fg 7142
  • fg-7142
  • fg7142
  • n-methyl-9h-$b-carboline-3-carboxamide
  • n-methyl-9h-pyrido(3,4-b)indole-3-carboxamide
  • n-methyl-9h-pyrido[5,4-b]indole-3-carboxamide
  • n-methyl-beta-carboline-3-carboxamide
  • pdsp1_001762
  • pdsp2_001745
  • tocris-0554
  • zk-39106
CAS Number(s)
  • 78538-74-6
InChIKey QMCOPDWHWYSJSA-UHFFFAOYSA-N
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