(1S)-1-Methyl-2,3,4,9-Tetrahydro-1H-β-Carboline

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Properties Simple | Detailed

Formula C12H14N2
IUPAC Name (1s)-1-methyl-1,2,3,4-tetrahydropyrido[3,4-b]indol-9-ium-9a-ylium
Molecular Mass 186.253 g·mol−1
Heat of Formation 170.2 ± 16.7 kJ·mol−1
Dipole Moment 2.79 ± 1.08 D
Volume 233.31 Å 3
Surface Area 220.51 Å 2
HOMO Energy -8.20 ± 0.55 eV
LUMO Energy 3.10 ± eV
Point Group Symmetry C1
Synonyms
  • (1s)-1-methyl-2,3,4,9-tetrahydro-1h-$b-carboline
  • (1s)-1-methyl-2,3,4,9-tetrahydro-1h-pyrido[3,4-b]indole
InChIKey LPIJOZBIVDCQTE-QMMMGPOBSA-N
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Elements H C N