1-(Phenylsulfonyl)-1H-Pyrrole

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Properties Simple | Detailed

Formula C10H9NO2S
IUPAC Name 1-(benzenesulfonyl)-2h-pyrrol-1-ium-2-ylium
Molecular Mass 207.249 g·mol−1
Heat of Formation -93.9 ± 16.7 kJ·mol−1
Dipole Moment 5.28 ± 1.08 D
Volume 231.45 Å 3
Surface Area 216.95 Å 2
HOMO Energy -9.07 ± 0.55 eV
LUMO Energy 2.10 ± eV
Point Group Symmetry Cs
Synonyms
  • 1-(phenylsulfonyl)pyrrole
  • 1-benzenesulfonyl-1h-pyrrole
  • n-benzenesulphonylpyrrole
CAS Number(s)
  • 16851-82-4
InChIKey PPPXRIUHKCOOMU-UHFFFAOYSA-N
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