Ioxitalamic Acid

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Properties Simple | Detailed

Formula C12H11I3N2O5
IUPAC Name 3-acetamido-5-(2-hydroxyethylcarbamoyl)-2,4,6-triiodo-benzoic acid
Molecular Mass 643.940 g·mol−1
Heat of Formation -586.7 ± 16.7 kJ·mol−1
Dipole Moment 2.71 ± 1.08 D
Volume 420.49 Å 3
Surface Area 343.46 Å 2
HOMO Energy -9.11 ± 0.55 eV
LUMO Energy -1.44 ± eV
Point Group Symmetry C1
Synonyms
  • 3-(acetylamino)-5-(((2-hydroxyethyl)amino)carbonyl)-2,4,6-triiodobenzoic acid
  • 3-acetamido-5-[(2-hydroxyethylamino)-oxomethyl]-2,4,6-triiodobenzoic acid
  • 5-acetamido-n-(2-hydroxyethyl)-2,4,6-triiodoisophthalamic acid
  • acido iossitalamico [dcit]
  • acidum joxitalamicum
  • foxitalamic acid
  • ioxitalamic acid [dcf:inn]
InChIKey OLAOYPRJVHUHCF-UHFFFAOYSA-N
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