1-(4,4-Diphenyl-3-Buten-1-Yl)-1,2,5,6-Tetrahydro-3-Pyridinecarboxylic Acid

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Properties Simple | Detailed

Formula C22H23NO2
IUPAC Name (1r)-1-(4,4-diphenylbut-3-enyl)-3,6-dihydro-2h-pyridine-5-carboxylic acid
Molecular Mass 333.424 g·mol−1
Heat of Formation -96.8 ± 16.7 kJ·mol−1
Dipole Moment 2.33 ± 1.08 D
Volume 418.1 Å 3
Surface Area 342.91 Å 2
HOMO Energy -8.88 ± 0.55 eV
LUMO Energy -0.11 ± eV
Point Group Symmetry C1
Synonyms
  • 1-[4,4-di(phenyl)but-3-enyl]-5,6-dihydro-2h-pyridine-3-carboxylic acid
  • 3-pyridinecarboxylic acid, 1-(4,4-diphenyl-3-butenyl)-1,2,5,6-tetrahydro-
  • n-(4,4-diphenyl-3-butenyl)guvacine
  • sk&f 100330-a
  • skf-100330a
CAS Number(s)
  • 85375-88-8
InChIKey NNHFTYXKYCVPFN-UHFFFAOYSA-N
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