Apricoxib

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Properties Simple | Detailed

Formula C19H20N2O3S
IUPAC Name 4-[2-(4-ethoxyphenyl)-4-methyl-pyrrol-1-ium-2-ylium-1-yl]benzenesulfonamide
Molecular Mass 356.439 g·mol−1
Heat of Formation -229.0 ± 16.7 kJ·mol−1
Dipole Moment 3.72 ± 1.08 D
Volume 422.2 Å 3
Surface Area 371.24 Å 2
HOMO Energy -8.76 ± 0.55 eV
LUMO Energy -0.86 ± eV
Point Group Symmetry C1
Synonyms
  • 4-[2-(4-ethoxyphenyl)-4-methyl-1-pyrrolyl]benzenesulfonamide
  • 4-[2-(4-ethoxyphenyl)-4-methyl-pyrrol-1-yl]benzenesulfonamide
  • 4-[2-(4-ethoxyphenyl)-4-methylpyrrol-1-yl]benzenesulfonamide
InChIKey JTMITOKKUMVWRT-UHFFFAOYSA-N
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