N-[(3R)-1-Azabicyclo[2.2.2]Oct-3-Yl]-4-Chlorobenzamide

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Properties Simple | Detailed

Formula C14H17ClN2O
IUPAC Name 4-chloro-n-[(3r)-quinuclidin-3-yl]benzamide
Molecular Mass 264.751 g·mol−1
Heat of Formation -118.4 ± 16.7 kJ·mol−1
Dipole Moment 2.48 ± 1.08 D
Volume 314.13 Å 3
Surface Area 281.94 Å 2
HOMO Energy -9.14 ± 0.55 eV
LUMO Energy -0.71 ± eV
Point Group Symmetry C1
Synonyms
  • 4-chloro-n-[(3r)-3-quinuclidinyl]benzamide
  • 4-chloro-n-[(3r)-quinuclidin-3-yl]benzamide
  • n-[(8r)-1-azabicyclo[2.2.2]octan-8-yl]-4-chloro-benzamide
  • n-[(8r)-1-azabicyclo[2.2.2]octan-8-yl]-4-chlorobenzamide
InChIKey WECKJONDRAUFDD-ZDUSSCGKSA-N
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Elements H C N O Cl