(S)-(-)-Cotinine

Molecule SVG Image

Properties Simple | Detailed

Formula C10H12N2O
IUPAC Name (5s)-1-methyl-5-(3-pyridyl)pyrrolidin-2-one
Molecular Mass 176.215 g·mol−1
Heat of Formation -65.6 ± 16.7 kJ·mol−1
Dipole Moment 5.32 ± 1.08 D
Volume 218.37 Å 3
Surface Area 204.28 Å 2
HOMO Energy -9.39 ± 0.55 eV
LUMO Energy -0.52 ± eV
Point Group Symmetry C1
Synonyms
  • (−)−cotinine solution
  • (−)-cotinine
  • (5s)-1-methyl-5-(3-pyridyl)-2-pyrrolidinone
  • (5s)-1-methyl-5-(3-pyridyl)-2-pyrrolidone
  • (5s)-1-methyl-5-(3-pyridyl)pyrrolidin-2-one
  • (5s)-1-methyl-5-pyridin-3-yl-pyrrolidin-2-one
  • (5s)-1-methyl-5-pyridin-3-ylpyrrolidin-2-one
  • (s)-1-methyl-5-(3-pyridyl)-2-pyrrolidinone
  • acon1_000202
  • bpbio1_000006
  • cotinine (-)
  • megxp0_001870
  • s(−)-1-methyl-5-(3-pyridyl)-2-pyrrolidone
  • sdccgmls-0066565.p001
InChIKey UIKROCXWUNQSPJ-VIFPVBQESA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N