[(3Z)-6-Oxo-3-{[4-(2-Pyridinylsulfamoyl)Phenyl]Hydrazono}-1,4-Cyclohexadien-1-Yl]Acetic Acid

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Formula C19H16N4O5S
IUPAC Name 2-[(3z)-6-oxo-3-[[4-(2-pyridylsulfamoyl)phenyl]hydrazono]cyclohexa-1,4-dien-1-yl]acetic acid
Molecular Mass 412.419 g·mol−1
Heat of Formation -367.2 ± 16.7 kJ·mol−1
Dipole Moment 3.96 ± 1.08 D
Volume 447.01 Å 3
Surface Area 401.54 Å 2
HOMO Energy -8.93 ± 0.55 eV
LUMO Energy -1.90 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[(3z)-6-keto-3-[[4-(2-pyridylsulfamoyl)phenyl]hydrazono]-1-cyclohexa-1,4-dienyl]acetic acid
  • 2-[(3z)-6-oxo-3-[[4-(2-pyridylsulfamoyl)phenyl]hydrazono]-1-cyclohexa-1,4-dienyl]acetic acid
  • 2-[(3z)-6-oxo-3-[[4-(pyridin-2-ylsulfamoyl)phenyl]hydrazinylidene]-1-cyclohexa-1,4-dienyl]acetic acid
  • 2-[(3z)-6-oxo-3-[[4-(pyridin-2-ylsulfamoyl)phenyl]hydrazinylidene]-1-cyclohexa-1,4-dienyl]ethanoic acid
InChIKey OCHFQLZWGLEZBT-JCMHNJIXSA-N
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