We present a systematic review of nanostructured organic materials, including synthesis methods, functionalization, and applications. First, we report the chemical and physical procedures used for preparing the polymer/carbon nanotube composites described in the literature over the last decade. We compare the properties of different polymer-based prototypes of organic nanocomposites functionalized with carbon nanotubes. Theoretical and experimental vibrational investigations provide evidence of the molecular structure describing the interaction between both components, showing that the allowed amount of carbon nanotubes and their dispersion states differ across polymers. Moreover, the nature of the solvent used in the preparation has a significant impact on the dispersion process. The integration of these materials in photovoltaic applications is discussed, where the impact of nanoparticles is evidenced through the correlation between experimental analyses and theoretical approaches based on density functional theory. Alterations in optical properties, evaluated from the absorption and luminescence process, are coherent with the solar spectrum, and a good distribution of donor/acceptor interpenetration was observed. In all cases, it was demonstrated that the performance improvement is physically related to the charge transfer from the organic matrix to the nanoparticles.

Two novel complexes, [(C₇H₁₀NO₂)CdCl₃]_n(I) and [(C₇H₉NO₂)CuCl₂],havebeen synthesized and characterized. Single crystal X-ray diffraction revealed that in compound (I), 2,6-dimethanol pyridinium acts as a monodentate ligand through the O atom of the hydroxyl group. Contrarily, the 2,6-dimethanol pyridine ligand interacts tridentately with the Cu(II) ion via the nitrogen atoms and the two oxygen (O, O’) atoms of the two hydroxyl groups. The structure’s intermolecular interactions were studied using contact enrichment ratios and Hirshfeld surfaces. Following metal coordination, numerous hydrogen connections between entities and parallel displacement stacking interactions between pyridine rings dictate the crystal packing of both compounds. The aromatic cycles generate layers in the crystal for both substances. Powder XRD measurements confirmed the crystalline sample phase purity. SEM confirmed the surface homogeneity, whereas EDX semi-quantitative analysis corroborated the composition. IR spectroscopy identified vibrational absorption bands, while optical UV-visible absorption spectroscopy investigated optical properties. The thermal stability of the two materials was tested using TG-DTA.

Polyaniline (PANI) was chemically doped and functionalized with single walled carbon nanotubes (SWCNTs). Various characterization methods were employed to study the structure and optical properties of PANI/SWCNTs nanocomposite, such as Fourier transform infrared (FTIR), differential scanning calorimetry (DSC), scanning electron microscopy (SEM), optical absorption, and stationary photoluminescence. Additionally, a theoretical study using density functional theory calculations was also carried out. It has been demonstrated that the doping process may reduce the band gap without affecting the molecular structure, leading to a better compatibility with the solar spectrum. Moreover, the functionalization process with SWCNTs was able to significantly improve the properties of the resulting nanocomposite. The final interpenetrating network of PANI/SWCNTs exhibited an optical gap of nearly 2.28 eV, from which localized states induced by the charge transfer were created at nearly 1.70 eV. In addition, the resulting donor–acceptor network leads to a separation of electron holes pairs rather than their recombination, which can be used as an active layer in photovoltaic applications and a photocatalyst for advanced oxidation processes.

In this paper, we report on the chemical preparation, crystal details, vibrational, optical, and thermal behavior, and antibacterial activity of a new non-centrosymmetric compound: 4-tert-butyl-pyridinium tetrachloridocuprate. X-ray diffraction analysis shows that the structure has a 3D network made up of C–H…Cl and N–H…Cl H-bonds, and [CuCl₄]²⁻ anions have a shape halfway between a tetrahedron and a square planar structure in this compound’s monoclinic system. Hirshfeld surface analysis was used to explain the nature and extent of intermolecular interactions, highlighting the importance of the H-bonds and the C–H⋯π interactions in the structure’s stabilization. Additionally, SEM/EDX experiments were conducted. The powder X-ray diffraction investigation at room temperature validated the material purity. Moreover, the different functional groups were identified using FT-IR spectroscopy. In addition, the optical properties were investigated using UV-Vis absorption. The thermal stability of (C₉H₁₄N)₂[CuCl₄] was performed by TGA-DTA. The bactericidal potency of the title compound was surveyed.

The chemical preparation, crystal structure, Hirshfeld surface analysis and spectroscopic characterization of the novel cadmium (II) 2,5-dichloro-p-phenylendiaminium decachlorotricadmate(II) hexahydrate complex, (C₆H₈Cl₂N₂)₂[Cd₃Cl₁₀]·6H₂O, has been reported. The atomic arrangement can be described as built up by an anionic framework, formed by edge-sharing [CdCl₆]²⁻ octahedra in linear polymeric chains spreading along the a-axis, while the organic cations surround these latters. The inspection of the Hirshfeld surface analysis helps to discuss the strength of hydrogen bonds and to quantify the inter-contacts, which reveal that H…Cl/Cl…H (38.9%), H…H (13.9%), and Cd…Cl/Cl…Cd (12.4%) are the main interactions that govern the crystal packing of the studied structure. SEM/EDXwas carried out and the powder XRD confirmed the good crystallinity of the material. FT-IR and the DFT calculation reveal the good correlation between the experimental and the theoretical wavenumbers. The HOMO-LUMO energy gap was used to predict the electric conductivity of the compound. Finally, the thermal TGA/DTA analysis shows stability until 380 K.