2-[2-Methoxy-4-(Methylsulfanyl)Phenyl]-1H-Imidazo[4,5-B]Pyridine

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Properties Simple | Detailed

Formula C14H13N3OS
IUPAC Name 2-(2-methoxy-4-methylsulfanyl-phenyl)imidazo[4,5-b]pyridin-1-ium-2-ylium
Molecular Mass 271.338 g·mol−1
Heat of Formation 214.8 ± 16.7 kJ·mol−1
Dipole Moment 5.32 ± 1.08 D
Volume 311.77 Å 3
Surface Area 287.51 Å 2
HOMO Energy -8.59 ± 0.55 eV
LUMO Energy -0.79 ± eV
Point Group Symmetry C1
Synonyms
  • 1h-imidazo(4,5-b)pyridine, 2-(2-methoxy-4-(methylthio)phenyl)-
  • 2-(2-methoxy-4-methylsulfanyl-phenyl)-1h-imidazo[4,5-b]pyridine
  • 2-(2-methoxy-4-methylsulfanylphenyl)-1h-imidazo[4,5-b]pyridine
  • 2-[2-methoxy-4-(methylthio)phenyl]-1h-imidazo[4,5-b]pyridine
  • ar-l 113 bs
  • sulmazole sulfide
InChIKey AYNBMCKKJDSJEV-UHFFFAOYSA-N
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