4-Methyl-1,2,5-Oxadiazole-3-Carboxamide 2-Oxide

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Properties Simple | Detailed

Formula C4H5N3O3
IUPAC Name 4-methyl-2-oxido-1,2,5-oxadiazol-2-ium-3-carboxamide
Molecular Mass 143.101 g·mol−1
Heat of Formation -40.8 ± 16.7 kJ·mol−1
Dipole Moment 1.31 ± 1.08 D
Volume 148.49 Å 3
Surface Area 154.6 Å 2
HOMO Energy -10.37 ± 0.55 eV
LUMO Energy 1.80 ± eV
Point Group Symmetry Cs
Synonyms
  • 3-furazancarboxamide, 4-methyl-, 2-oxide
  • 3-methyl-4-furoxancarboxamide
  • 3-methylfuroxan-4-carboxamide
  • 4-methyl-2-oxido-furazan-2-ium-3-carboxamide
  • 4-methyl-3-furazancarboxamide 2-oxide
  • 4-methyl-3-furoxancarboxamide
  • furazancarboxamide, 4-methyl-, 2-oxide
  • furazancarboxamide, 4-methyl-, 2-oxide (9ci)
CAS Number(s)
  • 37895-45-7
InChIKey YCIQUDDZPRNRMY-UHFFFAOYSA-N
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