(1S,2R,9R)-11-(3-Buten-1-Yl)-7,11-Diazatricyclo[7.3.1.0~2,7~]Tridec-5-En-4-One

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Formula C15H22N2O
IUPAC Name (1s,2r,9r)-11-(3-buten-1-yl)-7,11-diazatricyclo[7.3.1.0 2,7 ]tridec-5-en-4-one
Molecular Mass 246.348 g·mol−1
Heat of Formation -37.0 ± 16.7 kJ·mol−1
Dipole Moment 7.92 ± 1.08 D
Volume 321.78 Å 3
Surface Area 268.63 Å 2
HOMO Energy -8.39 ± 0.55 eV
LUMO Energy 0.62 ± eV
Point Group Symmetry C1
Synonyms
  • (-)-11,12-seco-12,13-didehydromultiflorine
  • 1,5-methano-10h-pyrido(1,2-a)(1,5)diazocin-10-one, 1,2,3,4,5,6,11,11a-octahydro-3-methyl-2-(2-propenyl)-, (1s-(1alpha,2alpha,5alpha,11aalpha))-
  • n-methylalbine
CAS Number(s)
  • 6822-63-5
InChIKey QEFLZWOIQICVRH-VNHYZAJKSA-N
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