figshare
Browse
gmcl_a_1263060_sm4281.docx (8.4 MB)

Mesomorphic and DFT studies of terminal ester containing salicylaldimines and their copper (II) complexes

Download (8.4 MB)
journal contribution
posted on 2017-02-23, 20:45 authored by Hemant Kumar Singh, Sachin Kumar Singh, Vijay Kumar, Priyanka Kanth, Kirtika Mishra, Bachcha Singh

In this article, we report synthesis and characterization of a novel homologous series of butyl 4-(4′-(alkoxy)-2-hydroxybenzylideneamino)benzoates, CnLH (n = 6, 8, 10, 12, 14, 16) and their copper(II) complexes. The mesomorphic properties of these compounds were investigated by differential scanning calorimetry (DSC), polarizing optical microscopy (POM) and powder X-ray diffraction (XRD) studies. The ligands and their copper(II) complexes exhibit wide range of enantiotropic smectic A mesophase as confirmed by their typical optical texture under polarizing microscope. Thermal stability of the compounds is determined by thermo gravimetric analyses. DFT calculations have been performed using GAUSSIAN-09 program at B3LYP level to obtain the stable electronic structure of the ligand and its copper(II) complex.

History

Usage metrics

    Molecular Crystals and Liquid Crystals

    Licence

    Exports

    RefWorks
    BibTeX
    Ref. manager
    Endnote
    DataCite
    NLM
    DC