2-[(Carboxycarbonyl)Amino]-5-Iodobenzoic Acid

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Properties Simple | Detailed

Formula C9H6INO5
IUPAC Name 5-iodo-2-(oxaloamino)benzoic acid
Molecular Mass 335.052 g·mol−1
Heat of Formation -709.3 ± 16.7 kJ·mol−1
Dipole Moment 1.33 ± 1.08 D
Volume 259.18 Å 3
Surface Area 247.2 Å 2
HOMO Energy -8.96 ± 0.55 eV
LUMO Energy -1.43 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(carboxycarbonylamino)-5-iodo-benzoic acid
  • 5-iodo-2-(oxalyl-amino)-benzoic acid
  • novo nordisk a/s compound
InChIKey SHSWHSQPJKMCPN-UHFFFAOYSA-N
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