N''-[(E)-(6-Oxo-2,4-Cyclohexadien-1-Ylidene)Methyl]-N'''-[(E)-2-Pyridinylmethylene]Thiocarbonohydrazide

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Properties Simple | Detailed

Formula C14H13N5OS
IUPAC Name 1-[[(e)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]-3-[(e)-2-pyridylmethyleneamino]thiourea
Molecular Mass 299.351 g·mol−1
Heat of Formation 528.8 ± 16.7 kJ·mol−1
Dipole Moment 7.04 ± 1.08 D
Volume 346.51 Å 3
Surface Area 333.69 Å 2
HOMO Energy -8.65 ± 0.55 eV
LUMO Energy -1.56 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(2-pyridylmethylidene)-5-(salicylidene)thiocarbonylhydrazone
  • 1-[(6-keto-1-cyclohexa-2,4-dienylidene)methylamino]-3-(2-pyridylmethyleneamino)thiourea
  • 1-[(6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-3-(2-pyridylmethyleneamino)thiourea
  • 1-[(6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-3-(pyridin-2-ylmethylideneamino)thiourea
  • 1-[[(e)-(6-keto-1-cyclohexa-2,4-dienylidene)methyl]amino]-3-(2-pyridylmethyleneamino)thiourea
  • 1-[[(e)-(6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]-3-(2-pyridylmethyleneamino)thiourea
  • 1-[[(e)-(6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]-3-(pyridin-2-ylmethylideneamino)thiourea
  • carbonothioic dihydrazide, ((2-hydroxyphenyl)methylene)(2-pyridinylmethylene)-
  • pmsth
CAS Number(s)
  • 95514-80-0
InChIKey JUKCIFHNDMCFOO-ATELFFGISA-N
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