3-(4-Methylphenyl)-4-[4-(Methylsulfonyl)Phenyl]-1-Propyl-1,5-Dihydro-2H-Pyrrol-2-One

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Properties Simple | Detailed

Formula C21H23NO3S
IUPAC Name 3-(4-methylsulfonylphenyl)-1-propyl-4-(p-tolyl)-2h-pyrrol-5-one
Molecular Mass 369.477 g·mol−1
Heat of Formation -331.5 ± 16.7 kJ·mol−1
Dipole Moment 3.42 ± 1.08 D
Volume 443.99 Å 3
Surface Area 373.99 Å 2
HOMO Energy -9.14 ± 0.55 eV
LUMO Energy -1.05 ± eV
Point Group Symmetry C1
Synonyms
  • 3-(4-methylphenyl)-4-(4-methylsulfonylphenyl)-1-propyl-5h-pyrrol-2-one
  • 4-(4-mesylphenyl)-3-(4-methylphenyl)-1-propyl-3-pyrrolin-2-one
InChIKey AXMZZGKKZDJGAZ-UHFFFAOYSA-N
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