(2E,4E)-4-Amino-6-Oxo-2,4-Heptadienedioic Acid

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Properties Simple | Detailed

Formula C7H7NO5
IUPAC Name (2e,4e)-4-amino-6-oxo-hepta-2,4-dienedioic acid
Molecular Mass 185.134 g·mol−1
Heat of Formation -755.4 ± 16.7 kJ·mol−1
Dipole Moment 4.80 ± 1.08 D
Volume 204.44 Å 3
Surface Area 205.77 Å 2
HOMO Energy -9.73 ± 0.55 eV
LUMO Energy 1.90 ± eV
Point Group Symmetry C1
Synonyms
  • (2e,4e)-4-amino-6-keto-hepta-2,4-dienedioic acid
  • (2e,4e)-4-amino-6-oxo-hepta-2,4-dienedioic acid
  • (2e,4e)-4-amino-6-oxohepta-2,4-dienedioic acid
  • 4-amino-2-oxo-3,5-heptadienedioic acid
  • 4-amino-6-carboxy-2-oxohexa-3,5-dienoate
  • acohda
CAS Number(s)
  • 151028-44-3
InChIKey SGUXCHHLXDUUHD-MVJNYCIBSA-N
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