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However, most previously reported works show that interchain embedding and edge grafting of the organic molecule can hardly be achieved simultaneously. Herein, we successfully synthesized organic molecule bifunctionalized CN (MBCN) through copolymerization of melon and sulfanilamide at a purposely elevated temperature of 550\u2009\u00b0C. In MBCN, the edge grafted and interchain embedded benzene rings act as the electron\u2010donating group and charge\u2010transfer channel, respectively, rendering efficient photocatalytic H<jats:sub>2<\/jats:sub>O<jats:sub>2<\/jats:sub> production. The optimal MBCN exhibits a significantly improved non\u2010sacrificial photocatalytic H<jats:sub>2<\/jats:sub>O<jats:sub>2<\/jats:sub> generation rate (54.0\u2005\u03bcmol\u2009g<jats:sup>\u22121<\/jats:sup>\u2009h<jats:sup>\u22121<\/jats:sup>) from pure water, which is 10.4\u2005times that of pristine CN. Experimental and density functional theory (DFT) calculation results reveal that the enhanced H<jats:sub>2<\/jats:sub>O<jats:sub>2<\/jats:sub> production activity of MBCN is mainly attributed to the improved photogenerated charge separation\/transfer and decreased formation energy barrier (\u25b5G) from O<jats:sup>2\u2212<\/jats:sup> to the intermediate 1,4\u2010endoperoxide (\u22c5OOH). This work suggests that simultaneous formation of electron donating group and charge transfer channel via organic molecule bifunctionalization is a feasible strategy for boosting the photocatalytic activity of CN.<\/jats:p>","DOI":"10.1002\/cssc.202300860","type":"journal-article","created":{"date-parts":[[2023,8,21]],"date-time":"2023-08-21T06:33:13Z","timestamp":1692599593000},"update-policy":"https:\/\/doi.org\/10.1002\/crossmark_policy","source":"Crossref","is-referenced-by-count":13,"title":["Organic Molecule Bifunctionalized Polymeric Carbon Nitride for Enhanced Photocatalytic Hydrogen Peroxide Production"],"prefix":"10.1002","volume":"16","author":[{"given":"Guiming","family":"Ba","sequence":"first","affiliation":[{"name":"TJU-NIMS International Collaboration Laboratory Key Laboratory of Advanced Ceramics and Machining Technology (Ministry of Education) and Tianjin Key Laboratory of Composite and Functional Materials School of Material Science and Engineering Tianjin University  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