Cdppb

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Properties Simple | Detailed

Formula C23H16N4O
IUPAC Name 3-cyano-n-(2,5-diphenylpyrazol-2-ium-1-id-3-yl)benzamide
Molecular Mass 364.399 g·mol−1
Heat of Formation 510.3 ± 16.7 kJ·mol−1
Dipole Moment 4.01 ± 1.08 D
Volume 431.5 Å 3
Surface Area 394.42 Å 2
HOMO Energy -8.79 ± 0.55 eV
LUMO Energy -1.30 ± eV
Point Group Symmetry C1
Synonyms
  • 3-cyano-n-(1,3-diphenyl-1h-pyrazol-5-yl)benzamide
  • 3-cyano-n-[2,5-di(phenyl)-3-pyrazolyl]benzamide
  • 3-cyano-n-[2,5-di(phenyl)pyrazol-3-yl]benzamide
InChIKey BKUIZWILNWHFHD-UHFFFAOYSA-N
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