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Monoazadichalcogenasumanenes: Synthesis, Structures, and Ring Reconstruction via Atom Transfer under Acidic Conditions

Jihai Shang, Renjie Wang, Chengshan Yuan, Zitong Liu, Hao‐Li Zhang, Xiangfeng Shao

2022Angewandte Chemie International Edition39 citationsDOI

Abstract

Buckybowls have unique properties that can be tailored by embedding main-group elements into their π-scaffolds. Herein, a synthetic approach is developed for producing monoazadichalcogenasumanenes (4 a/4 b, 6 a/6 b, 7 a/7 b) derived from sumanene by replacing its three benzylic carbons with one nitrogen and two chalcogen atoms (S for 4 a/4 b, Se for 6 a/6 b, Te for 7 a/7 b). Monoazadichalcogenasumanenes are deeper π-bowls than trichalcogensumanenes as the C-N bond is much shorter than C-X (X=S, Se, Te). The bowl-depth of 4 b (0.95 Å) is greater than that of corannulene (0.85 Å). The nitrogen atom donates electron density to the entire π-system that makes monoazadichalcogenasumanenes electron-rich. They undergo ring reconstruction of chalcogenophene ring via transferring a chalcogen atom from one molecule to another under acidic conditions. The nitrogen and chalcogen atoms play crucial role on this reaction.

Topics & Concepts

ChalcogenRing (chemistry)ChemistryAtom (system on chip)CrystallographyNitrogenNitrogen atomMoleculeOrganic chemistryEmbedded systemComputer scienceFullerene Chemistry and ApplicationsSynthesis and Properties of Aromatic CompoundsOrganic and Molecular Conductors Research
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