5-(4-(4-Chlorophenyl)-4-Hydroxypiperidin-1-Yl)-2,2-Diphenylpentanenitrile

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Properties Simple | Detailed

Formula C28H29ClN2O
IUPAC Name 5-[4-(4-chlorophenyl)-4-hydroxy-1-piperidyl]-2,2-diphenyl-pentanenitrile
Molecular Mass 444.996 g·mol−1
Heat of Formation 121.9 ± 16.7 kJ·mol−1
Dipole Moment 1.90 ± 1.08 D
Volume 550.35 Å 3
Surface Area 424.09 Å 2
HOMO Energy -9.11 ± 0.55 eV
LUMO Energy 2.78 ± eV
Point Group Symmetry C1
Synonyms
  • 5-[4-(4-chlorophenyl)-4-hydroxy-1-piperidinyl]-2,2-di(phenyl)pentanenitrile
  • 5-[4-(4-chlorophenyl)-4-hydroxy-1-piperidyl]-2,2-di(phenyl)pentanenitrile
  • 5-[4-(4-chlorophenyl)-4-hydroxy-1-piperidyl]-2,2-di(phenyl)valeronitrile
  • 5-[4-(4-chlorophenyl)-4-hydroxy-piperidin-1-yl]-2,2-di(phenyl)pentanenitrile
  • 5-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2,2-di(phenyl)pentanenitrile
InChIKey MEEJEEVTIVAOJP-UHFFFAOYSA-N
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Elements H C N O Cl