(1R,9R,13R)-1-(Dimethylamino)-11-Methyl-13-Vinyl-6-Azatricyclo[7.3.1.0~2,7~]Trideca-2(7),3,10-Trien-5-One

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Formula C17H22N2O+
IUPAC Name (1r,9r,13r)-1-(dimethylamino)-11-methyl-13-vinyl-6-azatricyclo[7.3.1.0 2,7 ]trideca-2(7),3,10-trien-5-one
Molecular Mass 270.369 g·mol−1
Heat of Formation -32.8 ± 16.7 kJ·mol−1
Dipole Moment 5.58 ± 1.08 D
Volume 341.66 Å 3
Surface Area 282.52 Å 2
HOMO Energy -8.70 ± 0.55 eV
LUMO Energy -0.14 ± eV
Point Group Symmetry C1
Synonyms
  • 5,9-methanocycloocta(b)pyridin-2(1h)-one, 5-(dimethylamino)-11-ethenyl-5,6,9,10-tetrahydro-7-methyl-, (5r-(5alpha,9beta,11r*))-
CAS Number(s)
  • 119188-49-7
InChIKey GDGWMBXSNPMXBY-OGHNNQOOSA-N
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