3-(~18~F)Fluoro-5-(2-Pyridinylethynyl)Benzonitrile

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Properties Simple | Detailed

Formula C14H7FN2
IUPAC Name 3-(18f)fluoranyl-5-[2-(2-pyridyl)ethynyl]benzonitrile
Molecular Mass 221.220 g·mol−1
Heat of Formation 415.6 ± 16.7 kJ·mol−1
Dipole Moment 5.06 ± 1.08 D
Volume 260.94 Å 3
Surface Area 261.16 Å 2
HOMO Energy -10.00 ± 0.55 eV
LUMO Energy -1.38 ± eV
Point Group Symmetry C1
Synonyms
  • [18f]3-fluoro-5-[(pyridin-3-yl)ethynyl]benzonitrile
  • [18f]f-peb
InChIKey MEZOEZSKPXUIJA-HUYCHCPVSA-N
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Elements H C N F