4-[4-(4-Fluorophenyl)-5-(4-Pyridinyl)-1,3-Dihydro-2H-Imidazol-2-Ylidene]-2,5-Cyclohexadien-1-One

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Properties Simple | Detailed

Formula C20H14FN3O
IUPAC Name 4-[4-(4-fluorophenyl)-5-(4-pyridyl)-1,3-dihydroimidazol-2-ylidene]cyclohexa-2,5-dien-1-one
Molecular Mass 331.343 g·mol−1
Heat of Formation 151.8 ± 16.7 kJ·mol−1
Dipole Moment 9.06 ± 1.08 D
Volume 380.72 Å 3
Surface Area 339.46 Å 2
HOMO Energy -7.92 ± 0.55 eV
LUMO Energy -1.49 ± eV
Point Group Symmetry C1
Synonyms
  • 4-(4-fluorophenyl)-2-(4-hydroxyphenyl)-5-(4-pyridyl)-1h-imidazole
  • 4-(4-fluorophenyl)-2-(4-hydroxyphenyl)-5-(4-pyridyl)1h-imidazole
  • 4-[4-(4-fluorophenyl)-5-(4-pyridyl)-1,3-dihydroimidazol-2-ylidene]-1-cyclohexa-2,5-dienone
  • 4-[4-(4-fluorophenyl)-5-(4-pyridyl)-1,3-dihydroimidazol-2-ylidene]cyclohexa-2,5-dien-1-one
  • 4-[4-(4-fluorophenyl)-5-pyridin-4-yl-1,3-dihydroimidazol-2-ylidene]cyclohexa-2,5-dien-1-one
  • bio1_000479
  • bio1_000968
  • bio1_001457
  • bio2_000393
  • bio2_000873
  • biomolki2_000057
  • biomolki_000051
  • fhpi
  • insolution™ sb 202190
  • phenol, 4-[4-(4-fluorophenyl)-5-(4-pyridinyl)-1h-imidazol-2-yl]-
  • sb 202190
  • sb 202190, immobilized
  • sb-202190
  • sb202190
  • smp2_000191
  • tocris-1264
CAS Number(s)
  • 152121-30-7
InChIKey NJNKPVPFGLGHPA-UHFFFAOYSA-N
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