N-(3,5-Difluorophenyl)-2-Pyridinecarbothioamide

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Properties Simple | Detailed

Formula C12H8F2N2S
IUPAC Name n-(3,5-difluorophenyl)pyridine-2-carbothioamide
Molecular Mass 250.267 g·mol−1
Heat of Formation -50.5 ± 16.7 kJ·mol−1
Dipole Moment 3.95 ± 1.08 D
Volume 274.93 Å 3
Surface Area 248.38 Å 2
HOMO Energy -8.79 ± 0.55 eV
LUMO Energy -1.28 ± eV
Point Group Symmetry C1
Synonyms
  • 2-pyridinecarbothioamide, n-(3,5-difluorophenyl)-
  • ay-31574
  • n-(3,5-difluorophenyl)pyridine-2-carbothioamide
CAS Number(s)
  • 119284-05-8
InChIKey AANZPLWMKOLXIU-UHFFFAOYSA-N
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Elements H S N C F