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

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Properties Simple | Detailed

Formula C17H26N2O2S
IUPAC Name n-[(2r,5r,11bs)-2,3,4,6,7,11b-hexahydro-1h-benzo[a]quinolizin-2-yl]-n-methyl-propane-1-sulfonamide
Molecular Mass 322.466 g·mol−1
Heat of Formation -310.2 ± 16.7 kJ·mol−1
Dipole Moment 3.69 ± 1.08 D
Volume 395.19 Å 3
Surface Area 337.52 Å 2
HOMO Energy -8.82 ± 0.55 eV
LUMO Energy 0.24 ± 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-methyl-propane-1-sulfonamide
  • n-[(2r,11bs)-2,3,4,6,7,11b-hexahydro-1h-pyrido[2,1-a]isoquinolin-2-yl]-n-methylpropane-1-sulfonamide
InChIKey LJPDFKRYOKWXMQ-WBVHZDCISA-N
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