2-(3,5-Difluorophenyl)-3-[4-(Methylsulfonyl)Phenyl]-2-Cyclopenten-1-One

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Properties Simple | Detailed

Formula C18H14F2O3S
IUPAC Name 2-(3,5-difluorophenyl)-3-(4-methylsulfonylphenyl)cyclopent-2-en-1-one
Molecular Mass 348.364 g·mol−1
Heat of Formation -654.1 ± 16.7 kJ·mol−1
Dipole Moment 1.42 ± 1.08 D
Volume 384.71 Å 3
Surface Area 332.72 Å 2
HOMO Energy -10.16 ± 0.55 eV
LUMO Energy 2.08 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(3,5-difluorophenyl)-3-(4-mesylphenyl)cyclopent-2-en-1-one
  • 2-(3,5-difluorophenyl)-3-(4-methylsulfonylphenyl)-1-cyclopent-2-enone
InChIKey ULFYMTMZNITFSB-UHFFFAOYSA-N
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