(1R,9As)-Octahydro-2H-Quinolizin-1-Ylmethanethiol

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Formula C10H19NS
IUPAC Name [(1r,5s,9as)-2,3,4,6,7,8,9,9a-octahydro-1h-quinolizin-1-yl]methanethiol
Molecular Mass 185.330 g·mol−1
Heat of Formation -68.7 ± 16.7 kJ·mol−1
Dipole Moment 2.20 ± 1.08 D
Volume 244.69 Å 3
Surface Area 222.77 Å 2
HOMO Energy -8.72 ± 0.55 eV
LUMO Energy -0.18 ± eV
Point Group Symmetry C1
Synonyms
  • [(1r,9as)-2,3,4,6,7,8,9,9a-octahydro-1h-quinolizin-1-yl]methanethiol
  • [(1r,9as)-quinolizidin-1-yl]methanethiol
InChIKey IDJFQEVIICXDDP-UWVGGRQHSA-N
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