A Single‐Molecule Junction Based on a Covalent Organic Cage

As the applications of molecular cages hinge on their properties, understanding the true nature of the cage structures is imperative. Single-molecule conductance technique offered a unique opportunity to explore the property of an individual cage structure, yet the undefined cage-electrode connection remains challenging. Herein, we designed a new single-molecule junction based on covalent organic cages with sulfur atoms on the edges as defined anchor groups. Using scanning tunneling microscopy break junction method, the single-molecule conductance was found at 10<sup>-3.5</sup> G₀, indicating the formation of a stable junction by the cage. The investigation, combining control structures and theoretical studies, confirmed that the conductance signal originates from the connection between gold electrodes and sulfur atoms in adjacent benzothiadiazole groups. This well-defined connection allowed us to analyze electron transport within the cage structure, providing new insights into the property investigation of functional cages.

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Publication Details

Journal
Angewandte Chemie International Edition
Published
2025-06-27
DOI
https://doi.org/10.1002/anie.202507894
Citations
1
Primary Topic
Molecular Junctions and Nanostructures
Type
article
Field-Weighted Citation Impact
0.73

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article

A Single‐Molecule Junction Based on a Covalent Organic Cage

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Angewandte Chemie International Edition
Molecular Junctions and Nanostructures
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article

A Single‐Molecule Junction Based on a Covalent Organic Cage

Sai‐Sai Yan, Daqiang Yuan, Dong Xiang, Baogui Huang, Kongzhao Su, Qian‐Chong Zhang, Miao Yang, Zhong‐Ning Chen, Lichuan Chen
article en
1 citations

Abstract

As the applications of molecular cages hinge on their properties, understanding the true nature of the cage structures is imperative. Single-molecule conductance technique offered a unique opportunity to explore the property of an individual cage structure, yet the undefined cage-electrode connection remains challenging. Herein, we designed a new single-molecule junction based on covalent organic cages with sulfur atoms on the edges as defined anchor groups. Using scanning tunneling microscopy break junction method, the single-molecule conductance was found at 10<sup>-3.5</sup> G₀, indicating the formation of a stable junction by the cage. The investigation, combining control structures and theoretical studies, confirmed that the conductance signal originates from the connection between gold electrodes and sulfur atoms in adjacent benzothiadiazole groups. This well-defined connection allowed us to analyze electron transport within the cage structure, providing new insights into the property investigation of functional cages.

Angewandte Chemie International EditionVol. 64(35)
Chinese Academy of Sciences (CN), Nankai University (CN), Zero to Three (US), Fujian Institute of Research on the Structure of Matter (CN), Tan Kah Kee Innovation Laboratory (CN), University of Chinese Academy of Sciences (CN), Xiamen Tobacco Industry (China) (CN), State Key Laboratory of Structural Chemistry, Xiamen University of Technology (CN)
Chinese Academy of Sciences, Natural Science Foundation of Fujian Province, Youth Innovation Promotion Association of the Chinese Academy of Sciences, Youth Innovation Promotion Association
Openalex Percentile: Top 27%
Molecular Junctions and Nanostructures
0.73
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