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1.
ACS Omega ; 8(27): 24601-24614, 2023 Jul 11.
Article in English | MEDLINE | ID: mdl-37457461

ABSTRACT

A new copper(II) coordination polymer was synthesized from the l-isoleucine-Schiff base and characterized by elemental analysis, Fourier transform infrared (FT-IR) spectroscopy, ultraviolet-visible (UV-vis) spectroscopy, single-crystal X-ray diffraction (XRD) analysis, electronic paramagnetic resonance, and thermogravimetric analysis. XRD analysis confirmed the square planar coordination geometry of metallic centers and a zipper-like polymer structure. Vibrational, electronic, and paramagnetic spectroscopies and thermal analysis were consistent with the crystal structure. A Hirshfeld surface (HS) and density functional theory (DFT) analyses were employed to gain additional insight into interactions responsible for complex packing. The quantitative examination of two-dimensional (2D) fingerprint plots revealed, among other van der Waals forces, the dominating participation of H···H and H···Cl interactions in the molecular packing. The use of computational methods provided great help in detailing the supramolecular interactions occurring in the crystal, which were mainly van der Waals attractions. The electronic transition analysis helped corroborate the electronic transitions observed experimentally in the absorption spectrum. The frequency and vibrational mode analysis gave a deeper insight into the characterization of the CuLCL complex.

2.
ACS Omega ; 7(35): 31059-31068, 2022 Sep 06.
Article in English | MEDLINE | ID: mdl-36092557

ABSTRACT

The purpose of this paper is to study the effect of polypyrrole (PPy) on cellulose acetate (CA) membranes prepared by the electrospinning technique (controlled variables) in the recovery of gold complexes of aqueous solutions that are environmentally ecofriendly. CA-PPy membranes were characterized by SEM, EDS, FTIR spectroscopy, contact angle measurements, electrical conductivity, and mechanical tests. They were submerged in two aqueous solutions using two gold complexes, AuI2 - and AuBr4 -, at room temperature. The recovery percentage was evaluated for several hours using the atomic adsorption technique for both complexes. The main findings indicate that the percentage of recovery in the first hours of the test was very high (>80%). The adsorption efficiency maxima were similar for both complexes (91%). The Langmuir model suggests the formation of a monolayer on the surface. The electrical conductivity did not change over time, and the mechanical properties indicate reuse in several experiments. Furthermore, the theoretical analysis showed that the system is helpful at acidic pH, funding its minimum energy. It is shown in this study that the used CA-PPy membranes show adsorption, absorption, and reusable properties with the effective recovery of the complexes in the first hours. These membranes could substitute for materials that are not environmentally ecofriendly.

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