N-{4-[(E)-(Carbamothioylhydrazono)Methyl]-2-Fluorophenyl}Acetamide

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Properties Simple | Detailed

Formula C10H11FN4OS
IUPAC Name n-[4-[(e)-(carbamothioylhydrazono)methyl]-2-fluoro-phenyl]acetamide
Molecular Mass 254.284 g·mol−1
Heat of Formation -104.2 ± 16.7 kJ·mol−1
Dipole Moment 7.39 ± 1.08 D
Volume 285.6 Å 3
Surface Area 278.63 Å 2
HOMO Energy -8.54 ± 0.55 eV
LUMO Energy -1.21 ± eV
Point Group Symmetry Cs
Synonyms
  • 4-acetamido-3-fluorobenzaldehyde thiosemicarbazone
  • n-[2-fluoro-4-[(e)-(thiocarbamoylhydrazono)methyl]phenyl]acetamide
  • n-[4-[(e)-(carbamothioylhydrazinylidene)methyl]-2-fluoro-phenyl]ethanamide
  • n-[4-[(e)-(carbamothioylhydrazinylidene)methyl]-2-fluorophenyl]acetamide
  • n-[4-[(e)-(carbamothioylhydrazono)methyl]-2-fluoro-phenyl]acetamide
  • n-[4-[(e)-(carbamothioylhydrazono)methyl]-2-fluorophenyl]acetamide
InChIKey LPOOMGIKZQEQHR-WLRTZDKTSA-N
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