(4Ar,9Br)-8-Methyl-2,3,4,4A,5,9B-Hexahydro-1H-Pyrido[4,3-B]Indole

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Formula C12H16N2
IUPAC Name (4ar,9br)-8-methyl-2,3,4,4a,5,9b-hexahydro-1h-pyrido[4,3-b]indole
Molecular Mass 188.269 g·mol−1
Heat of Formation 110.0 ± 16.7 kJ·mol−1
Dipole Moment 2.14 ± 1.08 D
Volume 241.85 Å 3
Surface Area 225.62 Å 2
HOMO Energy -8.44 ± 0.55 eV
LUMO Energy 0.29 ± eV
Point Group Symmetry C1
Synonyms
  • 1h-pyrido(4,3-b)indole, 2,3,4,4a,5,9b-hexahydro-8-methyl-, trans-
  • n-desmethylstobadine
  • ndms
CAS Number(s)
  • 70539-83-2
InChIKey XYIPZQCDLAFBSX-CMPLNLGQSA-N
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Elements H C N