5-Methoxy-2,3,4,9-Tetrahydro-1H-β-Carboline

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Properties Simple | Detailed

Formula C12H14N2O
IUPAC Name 5-methoxy-1,2,3,4-tetrahydropyrido[3,4-b]indol-9-ium-9a-ylium
Molecular Mass 202.252 g·mol−1
Heat of Formation 40.0 ± 16.7 kJ·mol−1
Dipole Moment 2.70 ± 1.08 D
Volume 244.79 Å 3
Surface Area 227.43 Å 2
HOMO Energy -8.16 ± 0.55 eV
LUMO Energy 0.04 ± eV
Point Group Symmetry C1
Synonyms
  • 1h-pyrido(3,4-b)indole, 2,3,4,9-tetrahydro-5-methoxy-
  • 5-methoxy-2,3,4,9-tetrahydro-1h-$b-carboline
  • 5-methoxy-2,3,4,9-tetrahydro-1h-pyrido[3,4-b]indole
  • 5-methoxytryptoline
CAS Number(s)
  • 30439-19-1
InChIKey VPZWHBCLJCKHGZ-UHFFFAOYSA-N
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