ABSTRACT
The purpose of this research was to learn more about the primary and secondary properties of Moroccan natural clay in an effort to better investigate innovative adsorbents and gain access to an ideal adsorption system. Scanning electron microscopy coupled with energy-dispersive X-ray spectroscopy analysis (SEM-EDX) and X-ray fluorescence were employed for identification. SEM revealed clay grains, including tiny particles and unevenly shaped sticks. First- and second-order rate laws, representing two distinct kinetic models, were applied in the kinetic approach. Adsorption of dye MB onto natural clay was studied, and the results agreed with the 2 s order model. The significant correlation coefficients support the inference that the adsorption process was governed by the Langmuir model. Subsequent DFT analyses demonstrated that the methylene blue dye's HOMO and LUMO surfaces are dispersed across most of the dye's components, pointing to a strong interaction with the clay. To determine how the dye might be adsorbed onto the clay, we employed quantum descriptors to locate its most nucleophilic and electrophilic centers. Endothermic reactions are evident during the MB adsorption process on clay, as indicated by the positive values of ΔH0 and ΔS0 (70.49 kJ mol-1of RC and 84.19 kJ mol-1 of OC and 10.45 J mol-1 K-1 of RC and 12.68 mol-1 K-1 of OC, respectively). Additionally dye molecules on the adsorbent exhibit a higher order of distribution than in the solution, indicating that the adsorption process is spontaneous.
ABSTRACT
In the title compound, C13H16N2S2, the seven-membered ring adopts a boat conformation, with the two phenyl-ene C atoms representing the stern and the methyl-ene C atom as the prow. The thione S atoms and N-bound ethyl groups lie on the opposite side of the mol-ecule to the phenyl-ene ring so that the mol-ecule approximates mirror symmetry. In the crystal, supra-molecular layers in the bc plane are sustained by a pair of C-Hâ¯S inter-actions to the same S atom acceptor.
ABSTRACT
Potassium cobalt hydrogenpyrophosphate dihydrate, KHCoP(2)O(7).2H(2)O, crystallizes in the orthorhombic space group Pnma. This salt is isotypic with KHMP(2)O(7).2H(2)O (M = Mn and Zn). The structure consists of alternating layers, built from HP(2)O(7)(3-) acidic pyrophosphate groups and CoO(6) octahedra, joined by potassium ions and bridging hydrogen bonds. The Co, K and water O atoms lie on mirror planes. The pyrophosphate group consists of two symmetry-related PO(4) groups, with the bridging O atom on a mirror plane.
ABSTRACT
The crystal structures of the isomorphous title compounds, namely potassium zinc hydrogen pyrophosphate dihydrate and potassium manganese hydrogen pyrophosphate dihydrate, consist of acidic pyrophosphate-metallate(II) layers joined by K(+) ions and hydrogen-bridging bonds. The Zn(2+)/Mn(2+) ions are octahedrally surrounded by four pyrophosphate O atoms and by two water molecules. The (HP(2)O(7))(3-) anions exhibit eclipsed conformations. The metal ions and water O atoms lie on mirror planes, as does the central O atom of the (HP(2)O(7))(3-) anion.
