6-[(E)-(Carbamothioylhydrazono)Methyl]-3-Pyridinyl Phenyl Carbonate

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Properties Simple | Detailed

Formula C14H12N4O3S
IUPAC Name [6-[(e)-(carbamothioylhydrazono)methyl]-3-pyridyl] phenyl carbonate
Molecular Mass 316.335 g·mol−1
Heat of Formation 15.0 ± 16.7 kJ·mol−1
Dipole Moment 6.95 ± 1.08 D
Volume 354.23 Å 3
Surface Area 339.61 Å 2
HOMO Energy -8.66 ± 0.55 eV
LUMO Energy -1.44 ± eV
Point Group Symmetry C1
Synonyms
  • 5-phenoxycarbonyloxy-2-formylpyridine thiosemicarbazone
  • [6-[(e)-(carbamothioylhydrazinylidene)methyl]pyridin-3-yl] phenyl carbonate
  • [6-[(e)-(carbamothioylhydrazono)methyl]-3-pyridyl] phenyl carbonate
  • carbonic acid [6-[(e)-(carbamothioylhydrazono)methyl]-3-pyridyl] phenyl ester
  • carbonic acid phenyl [6-[(e)-(thiocarbamoylhydrazono)methyl]-3-pyridyl] ester
  • carbonic acid, 6-(((aminothioxomethyl)hydrazono)methyl)-3-pyridinyl phenyl ester
CAS Number(s)
  • 52584-56-2
InChIKey PVZQRTVAYKXVDS-CAOOACKPSA-N
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