3-Fluoro-5-[3-(5-Fluoro-2-Pyridinyl)-1,2,4-Oxadiazol-5-Yl]Benzonitrile

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Properties Simple | Detailed

Formula C14H6F2N4O
IUPAC Name 3-fluoro-5-[3-(5-fluoro-2-pyridyl)-1,2,4-oxadiazol-5-yl]benzonitrile
Molecular Mass 284.220 g·mol−1
Heat of Formation 144.8 ± 16.7 kJ·mol−1
Dipole Moment 0.34 ± 1.08 D
Volume 301.55 Å 3
Surface Area 289.33 Å 2
HOMO Energy -10.26 ± 0.55 eV
LUMO Energy 1.03 ± eV
Point Group Symmetry Cs
Synonyms
  • 3-fluoro-5-[3-(5-fluoropyridin-2-yl)-1,2,4-oxadiazol-5-yl]benzonitrile
InChIKey RBSPCALDSNXWEP-UHFFFAOYSA-N
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Elements H C N O F