3-(4-Methoxyphenyl)-N-(Phenylsulfonyl)-1-[3-(Trifluoromethyl)Benzyl]-1H-Indole-2-Carboxamide

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Formula C30H23F3N2O4S
IUPAC Name n-(benzenesulfonyl)-3-(4-methoxyphenyl)-1-[[3-(trifluoromethyl)phenyl]methyl]indol-1-ium-2-carboxamide
Molecular Mass 564.575 g·mol−1
Heat of Formation -884.8 ± 16.7 kJ·mol−1
Dipole Moment 4.23 ± 1.08 D
Volume 624.07 Å 3
Surface Area 471.36 Å 2
HOMO Energy -8.54 ± 0.55 eV
LUMO Energy -0.74 ± eV
Point Group Symmetry C1
Synonyms
  • 3-(4-methoxyphenyl)-n-phenylsulfonyl-1-[3-(trifluoromethyl)benzyl]indole-2-carboxamide
  • 3-(4-methoxyphenyl)-n-phenylsulfonyl-1-[[3-(trifluoromethyl)phenyl]methyl]-2-indolecarboxamide
  • 3-(4-methoxyphenyl)-n-phenylsulfonyl-1-[[3-(trifluoromethyl)phenyl]methyl]indole-2-carboxamide
InChIKey BCPFCXDCWUXOGT-UHFFFAOYSA-N
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