4-Phenyl-3-(Trifluoromethyl)-1H-Pyrazole

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Properties Simple | Detailed

Formula C10H7F3N2
IUPAC Name 4-phenyl-3-(trifluoromethyl)pyrazol-1-ium-2-ide
Molecular Mass 212.171 g·mol−1
Heat of Formation -367.9 ± 16.7 kJ·mol−1
Dipole Moment 5.19 ± 1.08 D
Volume 225.44 Å 3
Surface Area 211.7 Å 2
HOMO Energy -9.67 ± 0.55 eV
LUMO Energy 2.73 ± eV
Point Group Symmetry C1
Synonyms
  • 4-phenyl-3-(trifluoromethyl)-2h-pyrazole
  • sew 02809
  • sr-01000633462-1
InChIKey WXEWNBPXLKAGHA-UHFFFAOYSA-N
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Elements H C N F