Copper(II) 2,2-Bis(Hydroxymethyl)Propionate Coordination Compounds with Hexamethylenetetramine: From Mononuclear Complex to One-Dimensional Coordination Polymer
MOLECULES(2021)
摘要
Three new copper coordination compounds derived from 2,2-bis(hydroxymethyl)propionic acid (dmpa) and hexamethylenetetramine (hmta) were obtained and their crystal structures were determined. The stoichiometry of the reagents applied in the syntheses reflects the metal to ligand molar ratio in the formed solid products. Due to the multiple coordination modes of the used ligands, wide structural diversity was achieved among synthesized compounds, i.e., mononuclear [Cu(dmp)(2)(hmta)(2)(H2O)] (1), dinuclear [Cu-2(dmp)(4)(hmta)(2)] (2), and 1D coordination polymer [Cu-2(dmp)(4)(hmta)](n) (3). Their supramolecular structures are governed by O-H center dot center dot center dot O and O-H center dot center dot center dot N hydrogen bonds. The compounds were characterized in terms of absorption (UV-Vis and IR) and thermal properties. The relationships between structural features and properties were discussed in detail. Owing to discrepancies in the coordination mode of a dmp ligand, bidentate chelating in 1, and bidentate bridging in 2 and 3, there is a noticeable change in the position of the bands corresponding to the stretching vibrations of the carboxylate group in the IR spectra. The differences in the structures of the compounds are also reflected in the nature and position of the UV-Vis absorption maxima, which are located at lower wavelengths for 1.
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关键词
copper,hexamethylenetetramine,2,2-bis(hydroxymethyl)propionate,crystal structure,coordination polymer,metal-ligand stoichiometry,UV-Vis,IR,thermal analysis,TD-DFT calculations
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