2-Phenyl-3H-Indol-3-One 1-Oxide

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Properties Simple | Detailed

Formula C14H9NO2
IUPAC Name 1-oxido-2-phenyl-indol-1-ium-3-one
Molecular Mass 223.227 g·mol−1
Heat of Formation 188.0 ± 16.7 kJ·mol−1
Dipole Moment 4.15 ± 1.08 D
Volume 252.24 Å 3
Surface Area 238.7 Å 2
HOMO Energy -8.79 ± 0.55 eV
LUMO Energy 1.15 ± eV
Point Group Symmetry C1
Synonyms
  • 1-oxido-2-phenyl-3-indol-1-iumone
  • 1-oxido-2-phenylindol-1-ium-3-one
  • 2-phenylisatogen
  • 3h-indol-3-one, 2-phenyl-, 1-oxide
  • 3h-indol-3-one, 2-phenyl-, 1-oxide (8ci)(9ci)
CAS Number(s)
  • 1969-74-0
InChIKey WXFLHMJSSLDOPA-UHFFFAOYSA-N
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