(2S)-1-Methyl-2-(3-Pyridinyl)-3,4-Dihydro-2H-Pyrrolium

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Properties Simple | Detailed

Formula C10H13N2+
IUPAC Name 3-[(2s)-1-methyl-3,4-dihydro-2h-pyrrol-1-ium-2-yl]pyridine
Molecular Mass 161.224 g·mol−1
Heat of Formation 1969.0 ± 16.7 kJ·mol−1
Dipole Moment 5.82 ± 1.08 D
Volume 182.73 Å 3
Surface Area 177.5 Å 2
HOMO Energy -9.10 ± 0.55 eV
LUMO Energy 0.60 ± eV
Point Group Symmetry Cs
Synonyms
  • 3-[(2s)-1-methyl-1-pyrrolin-1-ium-2-yl]pyridine
  • 3-[(2s)-1-methyl-3,4-dihydro-2h-pyrrol-1-ium-2-yl]pyridine
CAS Number(s)
  • 42459-13-2
InChIKey GTQXYYYOJZZJHL-JTQLQIEISA-N
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Elements C N