5-Hydroxy-1H-Indol-6-Yl Hydrogen Sulfate

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Properties Simple | Detailed

Formula C8H7NO5S
IUPAC Name (5-hydroxyindol-1-ium-6-yl) hydrogen sulfate
Molecular Mass 229.210 g·mol−1
Heat of Formation -691.1 ± 16.7 kJ·mol−1
Dipole Moment 5.61 ± 1.08 D
Volume 222.45 Å 3
Surface Area 214.24 Å 2
HOMO Energy -9.08 ± 0.55 eV
LUMO Energy -0.79 ± eV
Point Group Symmetry C1
Synonyms
  • (5-hydroxy-1h-indol-6-yl) hydrogen sulfate
  • 1h-indole-5,6-diol, 1-(((7-(dimethylamino)-2-oxo-2h-1-benzopyran-4-yl)acetyl)oxy)-, (+-)-
  • 5,6-dhis
  • 5-hydroxy-6-indolyl-o-sulfate
CAS Number(s)
  • 96686-60-1
InChIKey WADBTJLNKJQTOX-UHFFFAOYSA-N
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