1-(2-Chlorophenyl)-4-Cyano-5-(4-Methoxyphenyl)-N-Phenyl-1H-Pyrazole-3-Carboxamide

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Properties Simple | Detailed

Formula C24H17ClN4O2
IUPAC Name 1-(2-chlorophenyl)-4-cyano-5-(4-methoxyphenyl)-n-phenyl-pyrazol-1-ium-2-ide-3-carboxamide
Molecular Mass 428.870 g·mol−1
Heat of Formation 276.8 ± 16.7 kJ·mol−1
Dipole Moment 9.54 ± 1.08 D
Volume 482.84 Å 3
Surface Area 417.36 Å 2
HOMO Energy -8.75 ± 0.55 eV
LUMO Energy -1.20 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(2-chlorophenyl)-4-cyano-5-(4-methoxyphenyl)-1h-pyrazole-3-carboxylic acid phenylamide
  • 1-(2-chlorophenyl)-4-cyano-5-(4-methoxyphenyl)-n-phenyl-3-pyrazolecarboxamide
  • 1-(2-chlorophenyl)-4-cyano-5-(4-methoxyphenyl)-n-phenyl-pyrazole-3-carboxamide
  • 1-(2-chlorophenyl)-4-cyano-5-(4-methoxyphenyl)-n-phenylpyrazole-3-carboxamide
  • 1h-pyrazole-3-carboxamide, 1-(2-chlorophenyl)-4-cyano-5-(4-methoxyphenyl)-n-phenyl-
  • cp 272871
  • cp-272871
CAS Number(s)
  • 312494-20-5
InChIKey FDHOKMCJHQRFPP-UHFFFAOYSA-N
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