1-[(1R,6R)-9-Azabicyclo[4.2.1]Non-2-En-2-Yl]Ethanone

Molecule SVG Image

Properties Simple | Detailed

Formula C10H15NO
IUPAC Name 1-[(1r,6r)-9-azabicyclo[4.2.1]non-4-en-5-yl]ethanone
Molecular Mass 165.232 g·mol−1
Heat of Formation -141.2 ± 16.7 kJ·mol−1
Dipole Moment 4.26 ± 1.08 D
Volume 216.44 Å 3
Surface Area 198.28 Å 2
HOMO Energy -9.03 ± 0.55 eV
LUMO Energy 0.49 ± eV
Point Group Symmetry C1
Synonyms
  • 1-[(1r,6r)-9-azabicyclo[4.2.1]non-4-en-5-yl]ethanone
  • anatoxin
  • anatoxin i
  • anatoxin-a
  • antx-a
  • ethanone, 1-(1r,6r)-9-azabicyclo(4.2.1)non-2-en-2-yl-
  • pdsp1_000464
InChIKey SGNXVBOIDPPRJJ-PSASIEDQSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N