1H-1,2,4-Triazol-5-Ylformamide

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Properties Simple | Detailed

Formula C3H4N4O
IUPAC Name 4-aza-2-azonia-1-azanidacyclopenta-2,4-diene-3-carboxamide
Molecular Mass 112.090 g·mol−1
Heat of Formation 38.1 ± 16.7 kJ·mol−1
Dipole Moment 1.53 ± 1.08 D
Volume 121.94 Å 3
Surface Area 133.84 Å 2
HOMO Energy -10.81 ± 0.55 eV
LUMO Energy -0.79 ± eV
Point Group Symmetry Cs
Synonyms
  • 1,2,4-triazole-3-carboxamide
  • 1h-1,2,4-triazole-3-carboxamide
  • 2h-1,2,4-triazole-3-carboxamide
  • icn 1253
CAS Number(s)
  • 3641-08-5
InChIKey ZEWJFUNFEABPGL-UHFFFAOYSA-N
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