1-(3,4,5,5',6,6'-Hexahydro-2,3'-Bipyridin-1'(4'H)-Yl)Ethanone

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Properties Simple | Detailed

Formula C12H18N2O
IUPAC Name 1-[5-(2,3,4,5-tetrahydropyridin-6-yl)-3,4-dihydro-2h-pyridin-1-yl]ethanone
Molecular Mass 206.284 g·mol−1
Heat of Formation -169.0 ± 16.7 kJ·mol−1
Dipole Moment 3.96 ± 1.08 D
Volume 264.39 Å 3
Surface Area 247.93 Å 2
HOMO Energy -8.47 ± 0.55 eV
LUMO Energy 0.17 ± eV
Point Group Symmetry C1
Synonyms
  • 1-[3-(3,4,5,6-tetrahydropyridin-2-yl)-5,6-dihydro-4h-pyridin-1-yl]ethanone
  • 2,3'-bipyridine, 1'-acetyl-1',3,4,4',5,5',6,6'-octahydro-
  • n-acetylhystrine
CAS Number(s)
  • 52195-93-4
InChIKey VGALILHZAQZXRB-UHFFFAOYSA-N
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