5-Methoxy-2-{(S)-[(4-Methoxy-3,5-Dimethyl-2-Pyridinyl)Methyl]Sulfinyl}-1H-Imidazo[4,5-B]Pyridine

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Formula C16H18N4O3S
IUPAC Name 5-methoxy-2-[(s)-(4-methoxy-3,5-dimethyl-2-pyridyl)methylsulfinyl]imidazo[4,5-b]pyridin-1-ium-2-ylium
Molecular Mass 346.404 g·mol−1
Heat of Formation -127.7 ± 16.7 kJ·mol−1
Dipole Moment 2.76 ± 1.08 D
Volume 391.25 Å 3
Surface Area 351.46 Å 2
HOMO Energy -8.88 ± 0.55 eV
LUMO Energy -1.08 ± eV
Point Group Symmetry C1
Synonyms
  • 5-methoxy-2-[(s)-(4-methoxy-3,5-dimethyl-2-pyridyl)methylsulfinyl]-1h-imidazo[4,5-b]pyridine
  • 5-methoxy-2-[(s)-(4-methoxy-3,5-dimethyl-pyridin-2-yl)methylsulfinyl]-1h-imidazo[4,5-b]pyridine
InChIKey ZBFDAUIVDSSISP-DEOSSOPVSA-N
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