Esomeprazole

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Properties Simple | Detailed

Formula C17H19N3O3S
IUPAC Name 5-methoxy-2-[(s)-(4-methoxy-3,5-dimethyl-2-pyridyl)methylsulfinyl]benzimidazol-3-ium-2-ylium
Molecular Mass 345.416 g·mol−1
Heat of Formation -172.9 ± 16.7 kJ·mol−1
Dipole Moment 2.22 ± 1.08 D
Volume 398.33 Å 3
Surface Area 357.2 Å 2
HOMO Energy -8.61 ± 0.55 eV
LUMO Energy -0.46 ± eV
Point Group Symmetry C1
Synonyms
  • 1h-benzimidazole, 6-methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]sulfinyl]-
  • 6-methoxy-2-[(s)-(4-methoxy-3,5-dimethyl-2-pyridyl)methylsulfinyl]-1h-benzimidazole
  • 6-methoxy-2-[(s)-(4-methoxy-3,5-dimethyl-pyridin-2-yl)methylsulfinyl]-1h-benzimidazole
  • 6-methoxy-2-[(s)-(4-methoxy-3,5-dimethylpyridin-2-yl)methylsulfinyl]-1h-benzimidazole
  • 6-methoxy-2-{[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl]sulfinyl}-1h-benzimidazole
InChIKey SUBDBMMJDZJVOS-DEOSSOPVSA-N
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