1,2-Diphenyl-4-[2-(Phenylsulfonyl)Ethyl]-3,5-Pyrazolidinedione

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Properties Simple | Detailed

Formula C23H20N2O4S
IUPAC Name 4-[2-(benzenesulfonyl)ethyl]-1,2-diphenyl-pyrazolidine-3,5-dione
Molecular Mass 420.481 g·mol−1
Heat of Formation -251.0 ± 16.7 kJ·mol−1
Dipole Moment 6.40 ± 1.08 D
Volume 475.76 Å 3
Surface Area 358.97 Å 2
HOMO Energy -9.09 ± 0.55 eV
LUMO Energy -0.41 ± eV
Point Group Symmetry C1
Synonyms
  • 1,2-di(phenyl)-4-(2-phenylsulfonylethyl)pyrazolidine-3,5-dione
  • 1,2-di(phenyl)-4-(2-phenylsulfonylethyl)pyrazolidine-3,5-quinone
  • 1,2-diphenyl-4-(2-(phenylsulphonyl)ethyl)pyrazolidine-3,5-dione
  • g 31442
CAS Number(s)
  • 1106-50-9
InChIKey DQUYGWDNTAETLI-UHFFFAOYSA-N
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