Related Experiment Video
Updated: Jun 11, 2025

From Molecules to Materials: Engineering New Ionic Liquid Crystals Through Halogen Bonding
Published on: March 24, 2018
Synthesis, structural characterization, and theoretical analysis of novel zinc(ii) schiff base complexes with halogen
Md Gishan1, Puspendu Middya1, Michael G B Drew2
1Department of Chemistry, Jadavpur University Kolkata 700032 India shouvik.chattopadhyay@jadavpuruniversity.in.
Abstract:
In this article, we present the synthesis and characterization of three zinc(ii) complexes, [ZnII(HL1)2] (1), [ZnII(HL2)2]·2H2O (2) and [ZnII(HL3)2] (3), with three tridentate Schiff base ligands, H2L1, H2L2, and H2L3. The structures of the complexes were confirmed by single-crystal X-ray diffraction analysis. DFT calculations were performed to gain insights into the self-assembly of the complexes in their solid-state structures. Complex 1 exhibits dual halogen-bonding interactions (Br⋯Br and Br⋯O) in its solid-state structure, which have been thoroughly investigated through molecular electrostatic potential (MEP) surface calculations, alongside QTAIM and NCIPlot analyses. Furthermore, complex 2 features a fascinating hydrogen-bonding network involving lattice water molecules, which serves to link the [ZnII(HL2)2] units into a one-dimensional supramolecular polymer. This network has been meticulously examined using QTAIM and NCIplot analyses, allowing for an estimation of the hydrogen bond strengths. The significance of H-bonds and CH⋯π interactions in complex 3 was investigated, as these interactions are crucial for the formation of infinite 1D chains in the solid state.
More Related Videos
08:15Synthesis of Nine-atom Deltahedral Zintl Ions of Germanium and their Functionalization with Organic Groups
Published on: February 11, 2012
06:35Construction and Systematical Symmetric Studies of a Series of Supramolecular Clusters with Binary or Ternary Ammonium Triphenylacetates
Published on: February 15, 2016
Related Concept Videos
Valence Bond Theory
Crystal Field Theory - Tetrahedral and Square Planar Complexes
Crystal field theory (CFT) is applicable to molecules in geometries other than octahedral. In octahedral complexes, the lobes of the dx2−y2 and dz2 orbitals point directly at the ligands. For tetrahedral complexes, the d orbitals remain in place, but with only four ligands located between the axes. None of the orbitals points directly at the tetrahedral ligands. However, the dx2−y2 and dz2 orbitals (along the Cartesian axes) overlap with the ligands less than the dxy,...
Diazonium Group Substitution: –OH and –H
Structural Isomerism
Isomers are different chemical species that have the same chemical formula. Structural isomerism of coordination compounds can be divided into two subcategories, the linkage isomers and coordination-sphere isomers.
Linkage isomers occur when the coordination compound contains a ligand that can bind to the transition metal center through two different atoms. For example, the CN− ligand can bind through the carbon atom or through the nitrogen atom. Similarly, SCN− can...
Diazonium Group Substitution with Halogens and Cyanide: Sandmeyer and Schiemann Reactions
Coordination Compounds and Nomenclature