Single crystals of a new organic–inorganic hybrid compound (C₃H₇N₆)₂[ZnCl₄]·H₂O was synthesized and characterized by X-ray diffraction at room temperature, FT-IR and FT-Raman spectroscopies, optical absorption and photoluminescence behavior. The title compound belongs to the triclinic space group P$\overline{1},$ and in the crystal structure, the inorganic layers are built from tetrachloridozincate anions [ZnCl₄]²⁻ and free water molecules, linked together by O–H···Cl hydrogen bonds and halogen···halogen interactions. In addition, Hirshfeld surfaces and 2D fingerprint plots estimate the weak intermolecular interactions accountable for the generation of crystal packing. The optimized geometry, vibrational frequencies and various thermodynamic parameters of the title compound calculated using density functional theory (DFT) methods are in agreement with the experimental values. The theoretical calculations were performed using the DFT method at WB97XD/Lanl2dz basis set levels and we discussed topological analysis of atoms in molecules (AIM) at the BCP point. A detailed interpretation of the IR and Raman spectra were reported. Additionally, the simulated spectrum satisfactorily coincided with the experimental UV-Visible spectrum. A wide band gap exceeding 4 eV of the synthesized compound was recorded. The photoluminescence (PL) was characterized through two bands successively at 453 and 477 nm. Ultimately, antimicrobial activity and enzymatic inhibition assays of the complex were also investigated through microbial strains, agar diffusion method, minimum inhibitory concentration (MIC) determination, lipase and phospholipase A₂ inhibition.

Zinc oxide nanoparticles (ZnO NPs) were synthesized using a simple and eco-friendly precipitation method, employing a capping agent derived from chia seeds (Salvia hispanica). X-ray diffraction (XRD) analysis confirmed the formation of ZnO with a hexagonal crystal structure and an average crystallite size of less than 30 nm. Scanning electron microscopy (SEM) revealed distinct quasi-spherical and nanorod-like morphologies, while energy-dispersive X-ray spectroscopy (EDX) verified the presence of zinc and oxygen. Diffuse reflectance spectroscopy (DRS) indicated significant activity in the UV region, with the nanoparticles exhibiting a band gap of 3.25 eV. The photocatalytic efficiency of the synthesized ZnO NPs was evaluated through their ability to degrade diclofenac sodium (DCF) and para-nitrophenol (4-nitrophenol, PNP) under UV-LED irradiation, achieving pollutant removal rates exceeding 98%. The degradation mechanism is clarified by a detailed characterization of the reaction intermediates. These findings highlight the potential of ZnO NPs synthesized from chia seed extract for effective environmental remediation of pharmaceutical and organic pollutants.