Charge Transport through Single-Molecule Junctions with σ-Delocalized Systems

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Abstract

Single-molecule junctions, formed by a single molecule bridging a gap between two metal electrodes, are attracting attention as basic models of ultrasmall electronic devices. Although charge transport through π-conjugated molecules with π-delocalized system has been widely studied for a number of molecular junctions, there has been almost no research on charge transport through molecular junctions with a σ-delocalized orbital system. Compounds with hexa-selenium-substituted benzene form a σ-delocalized orbital system on the periphery of the benzene ring. In this study, we fabricated single-molecule junctions with the σ-delocalized orbital systems arising from lone-pair interactions of selenium atoms and clarified their electronic properties using the break-junction method. The single-molecule junctions with the σ-orbital systems show efficient charge transport properties and can be one of the alternatives to those with conventional π-orbital systems as minute electronic conductors.

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Fujii, S., Seko, S., Tanaka, T., Yoshihara, Y., Furukawa, S., Nishino, T., & Saito, M. (2024). Charge Transport through Single-Molecule Junctions with σ-Delocalized Systems. Journal of the American Chemical Society, 146(28), 19566–19571. https://doi.org/10.1021/jacs.4c06732

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