4,5,6,7-Tetrahydro-1H-Indole

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Properties Simple | Detailed

Formula C8H11N
IUPAC Name 4,5,6,7-tetrahydro-3h-indol-1-ium-3-ide
Molecular Mass 121.180 g·mol−1
Heat of Formation 43.8 ± 16.7 kJ·mol−1
Dipole Moment 2.11 ± 1.08 D
Volume 159.82 Å 3
Surface Area 160.98 Å 2
HOMO Energy -8.38 ± 0.55 eV
LUMO Energy 4.24 ± eV
Point Group Symmetry C1
Synonyms
  • 1h-indole, 4,5,6,7-tetrahydro-
  • 4,5,6,7-tetrahydroindole
  • methyl (1-methyl-1h-pyrrol-2-yl)acetate
CAS Number(s)
  • 13618-91-2
InChIKey KQBVVLOYXDVATK-UHFFFAOYSA-N
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Elements H C N