3-Fluoro-5-(2-Pyridinylethynyl)Benzonitrile

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Properties Simple | Detailed

Formula C14H7FN2
IUPAC Name 3-fluoro-5-[2-(2-pyridyl)ethynyl]benzonitrile
Molecular Mass 222.217 g·mol−1
Heat of Formation 415.6 ± 16.7 kJ·mol−1
Dipole Moment 5.10 ± 1.08 D
Volume 261.31 Å 3
Surface Area 261.2 Å 2
HOMO Energy -10.01 ± 0.55 eV
LUMO Energy 1.63 ± eV
Point Group Symmetry C1
InChIKey MEZOEZSKPXUIJA-UHFFFAOYSA-N
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Elements H C N F