(2S,3As,6R,7As)-6-Hydroxyoctahydro-1H-Indole-2-Carbaldehyde

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Formula C9H15NO2
IUPAC Name (2s,3as,6r,7as)-6-hydroxy-2,3,3a,4,5,6,7,7a-octahydro-1h-indole-2-carbaldehyde
Molecular Mass 169.221 g·mol−1
Heat of Formation -343.4 ± 16.7 kJ·mol−1
Dipole Moment 3.79 ± 1.08 D
Volume 215.73 Å 3
Surface Area 197.64 Å 2
HOMO Energy -9.06 ± 0.55 eV
LUMO Energy 0.74 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,3as,6r,7as)-6-hydroxy-2,3,3a,4,5,6,7,7a-octahydro-1h-indole-2-carbaldehyde
  • (2s,3as,6r,7as)-6-hydroxy-2,3,3a,4,5,6,7,7a-octahydro-1h-indole-2-carboxaldehyde
  • 6-hydroxo-octahydro-indole-2-carbaldehyde
InChIKey KEECRFMFXJKBLP-MAUMQABQSA-N
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