1,3,4-Oxadiazole

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Properties Simple | Detailed

Formula C2H2N2O
IUPAC Name 1,3,4-oxadiazole
Molecular Mass 70.050 g·mol−1
Heat of Formation 72.0 ± 16.7 kJ·mol−1
Dipole Moment 3.76 ± 1.08 D
Volume 77.59 Å 3
Surface Area 92.83 Å 2
HOMO Energy -11.25 ± 0.55 eV
LUMO Energy 2.38 ± eV
Point Group Symmetry C2v
Synonyms
  • 1-oxa-3,4-diazacyclopentadiene
CAS Number(s)
  • 288-99-3
InChIKey FKASFBLJDCHBNZ-UHFFFAOYSA-N
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