Title of article :
Synthesis and crystal structure of (E)-2-({2-[azaniumylidene(methylsulfanyl)methyl]hydrazinylidene}methyl)benzene-1,4-diol hydrogen sulfate
Author/Authors :
Nehar, Oussama Laboratoire de Chimie Inorganique et Environnement - Université de Tlemcen, Algeria , Louhibi, Samira Laboratoire de Chimie Inorganique et Environnement - Université de Tlemcen, Algeria , Roisnel, Thierry Centre de Diffractometrie X - UMR 6226 CNRS - Unit Sciences Chimiques de Rennes - Universite de Rennes I, France
Abstract :
The title molecular salt, C9H12N3O2S+·HSO4−, was obtained through the protonation of the azomethine N atom in a sulfuric acid medium. The crystal comprises two entities, a thiosemicarbazide cation and a hydrogen sulfate anion. The cation is essentially planar and is further stabilized by a strong intramolecular O—H⋯N hydrogen bond. In the crystal, a three-dimensional network is established through O—H⋯O and N—H⋯O hydrogen bonds. A weak intermolecular C—H⋯O hydrogen bond is also observed. The hydrogen sulfate anion exhibits disorder over two sets of sites and was modelled with refined occupancies of 0.501 (6) and 0.499 (6).
Keywords :
crystal structure , thiosemicarbazone , hydrogen bonding , organic salt
Journal title :
Acta Crystallographica Section E: Crystallographic Communications