(3R)-1-(4,4-Diphenyl-3-Buten-1-Yl)-3-Piperidinecarboxylic Acid

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Properties Simple | Detailed

Formula C22H25NO2
IUPAC Name (1r,3r)-1-(4,4-diphenylbut-3-enyl)piperidine-3-carboxylic acid
Molecular Mass 335.439 g·mol−1
Heat of Formation -193.9 ± 16.7 kJ·mol−1
Dipole Moment 1.39 ± 1.08 D
Volume 426.06 Å 3
Surface Area 356.95 Å 2
HOMO Energy -8.90 ± 0.55 eV
LUMO Energy -0.05 ± eV
Point Group Symmetry C1
Synonyms
  • (3r)-1-[4,4-di(phenyl)but-3-enyl]-3-piperidinecarboxylic acid
  • (3r)-1-[4,4-di(phenyl)but-3-enyl]nipecotic acid
  • (3r)-1-[4,4-di(phenyl)but-3-enyl]piperidine-3-carboxylic acid
InChIKey TXQKSMSLZVKQBI-HXUWFJFHSA-N
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