Title of article :
Crystal structure of trans-diaquabis(nicotinamide-κN1)bis(4-nitrobenzoato-κO)manganese(II)
Author/Authors :
Aşkın, Gülçin Şefiye Department of Physics - Hacettepe University, Turkey , Necefoğlu, Hacali Department of Chemistry - Kafkas University, Turkey , Tonbul, Ali Murat Department of Chemistry - Kafkas University, Turkey , Dilekd, Nefise Department of Physics - Aksaray University, Turkey , Hökeleka, Tuncer Department of Physics - Hacettepe University, Turkey
Abstract :
The asymmetric unit of the title compound, [Mn(C7H4NO4)2(C6H6N2O)2(H2O)2], contains one MnII atom, one 4-nitrobenzoate (NB) anion, one nicotinamide (NA) ligand and one water molecule; NA and NB each act as a monodentate ligand. The MnII atom, lying on an inversion centre, is coordinated by four O atoms and two pyridine N atoms in a distorted octahedral geometry. The water molecules are hydrogen bonded to the carboxylate O atoms. The dihedral angle between the carboxylate group and the adjacent benzene ring is 24.4 (3)°, while the benzene and pyridine rings are oriented at a dihedral angle of 86.63 (11)°. In the crystal, O—H⋯O and N—H⋯O hydrogen bonds link the molecules, forming a layer parallel to the ab plane. The layers are further linked via weak C—H⋯O hydrogen bonds, a π–π stacking interaction [centroid–centroid distance = 3.868 (2) Å] and a weak C—H⋯π interaction, resulting in a three-dimensional network.
Keywords :
crystal structure , transition metal complex , 4-nitrobenzoic acid , nicotinamide , manganese(II)
Journal title :
Acta Crystallographica Section E: Crystallographic Communications