Pyrrolidine, 1-(1-Oxo-4-Phenylbutyl)-2-(1-Pyrolidinylcarbonyl)-, (S)-

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Properties Simple | Detailed

Formula C19H26N2O2
IUPAC Name 4-phenyl-1-[(2s)-2-(pyrrolidine-1-carbonyl)pyrrolidin-1-yl]butan-1-one
Molecular Mass 314.422 g·mol−1
Heat of Formation -350.8 ± 16.7 kJ·mol−1
Dipole Moment 1.44 ± 1.08 D
Volume 400.82 Å 3
Surface Area 360.05 Å 2
HOMO Energy -9.00 ± 0.55 eV
LUMO Energy 0.32 ± eV
Point Group Symmetry C1
Synonyms
  • 1-[(2s)-2-(oxo-1-pyrrolidinylmethyl)-1-pyrrolidinyl]-4-phenylbutan-1-one
  • 4-phenyl-1-[(2s)-2-(pyrrolidine-1-carbonyl)pyrrolidin-1-yl]butan-1-one
  • 4-phenyl-1-[(2s)-2-pyrrolidin-1-ylcarbonylpyrrolidin-1-yl]butan-1-one
  • n-(n-(phenyl)butyryl-l-prolyl)pyrrolidine
  • suam 1221
  • suam-1221
CAS Number(s)
  • 112603-82-4
InChIKey HDRSLHFTJYMQIL-KRWDZBQOSA-N
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