Unveiling the supramolecular assembly of a novel antimony( iii )-based co-crystal: integrating multi-spectroscopic analyses, DFT calculations, and advanced biological evaluations

Key Points

• The research aims to prepare and analyze a novel antimony(iii) co-crystal using hydrothermal methods.
• Co-crystal PdzSb was synthesized under hydrothermal conditions at 140 °C.
• The structure and properties were analyzed using multiple physicochemical techniques.
• Density Functional Theory (DFT) calculations were performed to support findings.
• The successful synthesis of the co-crystal PdzSb was achieved under specified conditions.
• Comprehensive analyses confirmed its unique physicochemical properties.
• DFT calculations aligned with experimental data, revealing insights into molecular interactions.