1H-Indole-1,2,3-Triol

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Properties Simple | Detailed

Formula C8H7NO3
IUPAC Name 1-hydroxyindol-1-ium-2,3-diol
Molecular Mass 165.146 g·mol−1
Heat of Formation -167.7 ± 16.7 kJ·mol−1
Dipole Moment 1.23 ± 1.08 D
Volume 180.74 Å 3
Surface Area 180.31 Å 2
HOMO Energy -8.42 ± 0.55 eV
LUMO Energy -0.56 ± eV
Point Group Symmetry C1
Synonyms
  • 1-hydroxyindole-2,3-diol
  • 1h-indolediol, hydroxy-
  • trihydroxyindole
CAS Number(s)
  • 28986-53-0
InChIKey PMEOIJLUJVRFOD-UHFFFAOYSA-N
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