4-Oxo-4,5-Dihydro-1,2,5-Oxadiazole-3-Carboxylic Acid

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Properties Simple | Detailed

Formula C3H2N2O4
IUPAC Name 4-oxo-1,2,5-oxadiazole-3-carboxylic acid
Molecular Mass 130.059 g·mol−1
Heat of Formation -309.2 ± 16.7 kJ·mol−1
Dipole Moment 3.01 ± 1.08 D
Volume 125.87 Å 3
Surface Area 137.63 Å 2
HOMO Energy -10.68 ± 0.55 eV
LUMO Energy 1.56 ± eV
Point Group Symmetry C1
Synonyms
  • 4-ketofurazan-3-carboxylic acid
  • oxq
InChIKey IBRWUZLLHSXPKL-UHFFFAOYSA-N
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