Title of article :
Crystal structure of bis[2,5-bis(pyridin-2-yl)-1,3,4-thiadiazole-κ2N2,N3]bis(thiocyanato-κS)copper(II)
Author/Authors :
Laachir, Abdelhakim Laboratoire de Chimie de Coordination et d'Analytique (LCCA) - Faculté des Sciences - Université Chouaib Doukkali, Morocco , Bentiss, Fouad Laboratoire de Catalyse et de Corrosion de Matériaux (LCCM) - Faculté des Sciences - Université Chouaib Doukkali, Morocco , Guesmi, Salaheddine Laboratoire de Chimie du Solide Appliquée - Faculty of Sciences - Mohammed V University in Rabat, Morocco , Ammari, Lahcen El Laboratoire de Chimie du Solide Appliquée - Faculty of Sciences - Mohammed V University in Rabat, Morocco
Abstract :
The mononuclear title complex, [Cu(SCN)2(C12H8N4S)2], was obtained by the reaction of 2,5-bis(pyridin-2-yl)-1,3,4-thiadiazole and potassium thiocyanate with copper(II) chloride dihydrate. The copper cation lies on an inversion centre and displays an elongated octahedral coordination geometry. The equatorial positions are occupied by the N atoms of two 2,5-bis(pyridin-2-yl)-1,3,4-thiadiazole ligands, whereas the axial positions are occupied by the S atoms of two thiocyanate anions. The thiadiazole and the pyridyl rings linked to the metal are approximately coplanar, with a maximum deviation from the mean plane of 0.190 (2) Å. The cohesion of the crystal structure is ensured by weak C—H⋯N hydrogen bonds and π–π interactions between parallel pyridyl rings of neighbouring molecules [centroid-to-centroid distance = 3.663 (2) Å], leading to a three-dimensional network.
Keywords :
crystal structure , thiocyanate ligand , 2,5-bis(pyridin-2-yl)-1,3,4-thiadiazole , copper complex
Journal title :
Acta Crystallographica Section E: Crystallographic Communications