N-[(2R,11Bs)-1,3,4,6,7,11B-Hexahydro-2H-Pyrido[2,1-A]Isoquinolin-2-Yl]-N-Phenylpropanamide

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Formula C22H26N2O
IUPAC Name n-[(2r,5r,11bs)-2,3,4,6,7,11b-hexahydro-1h-benzo[a]quinolizin-2-yl]-n-phenyl-propanamide
Molecular Mass 334.455 g·mol−1
Heat of Formation -25.4 ± 16.7 kJ·mol−1
Dipole Moment 2.54 ± 1.08 D
Volume 423.26 Å 3
Surface Area 358.55 Å 2
HOMO Energy -8.74 ± 0.55 eV
LUMO Energy 2.90 ± eV
Point Group Symmetry C1
Synonyms
  • n-[(2r,11bs)-2,3,4,6,7,11b-hexahydro-1h-pyrido[2,1-a]isoquinolin-2-yl]-n-phenyl-propanamide
  • n-[(2r,11bs)-2,3,4,6,7,11b-hexahydro-1h-pyrido[2,1-a]isoquinolin-2-yl]-n-phenyl-propionamide
InChIKey INISVGFBGYOYGS-CTNGQTDRSA-N
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