"FANCI Lab investigates the origin, nature, and applications of noncovalent interactions in molecular and supramolecular systems. Our research spans fundamental understanding of weak forces and their translation into functional applications in catalysis, crystal engineering, and materials design"
At FANCI Lab, we investigate the origin, nature, and strength of noncovalent interactions that govern molecular structure and behavior. Our studies focus on hydrogen, halogen, chalcogen, pnictogen, and triel bonding, among other weak forces. Using quantum chemical calculations, energy decomposition analysis (EDA), QTAIM, and NCI plot methods, we uncover how these interactions influence molecular conformation, recognition, and reactivity, providing a rigorous foundation for both understanding and predicting chemical behavior.
Noncovalent interactions play a central role in molecular assembly and crystal packing. Our lab studies how these forces direct supramolecular organization, polymorphism, and material properties using single-crystal X-ray diffraction (SCXRD) and computational modeling. By correlating interaction motifs with crystal structures, we aim to predict and design molecular assemblies with tailored properties for applications in solid-state chemistry and functional materials.
Materials Design & Functional Systems
FANCI Lab applies molecular insights to the design of advanced functional materials. Through strategic exploitation of noncovalent interactions, we develop organic, supramolecular, and hybrid materials with unique electronic, optical, or mechanical properties. This theme bridges fundamental chemistry with material innovation, enabling the creation of systems with tunable behavior for applications in electronics, photonics, and molecular recognition.
Catalysis Design
We leverage insights from noncovalent interactions to design catalysts with enhanced selectivity and efficiency rationally. By understanding how weak forces modulate activation and transition states, FANCI Lab develops organocatalysts, metal-complex catalysts, and supramolecular catalytic systems that exploit these interactions. This research bridges fundamental understanding with practical applications, enabling the design of more sustainable and efficient chemical transformations.