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000617130 1001_ $$0P:(DE-H253)PIP1094243$$aNiyas, M. A.$$b0
000617130 245__ $$aTernary $π–π$ Stacking Complexes by Allosteric Regulation in Multilayer Nanographenes
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000617130 520__ $$aConstruction of π–π stacking supramolecular complexes with more than two different components is challenging due to the weak and directionless nature of dispersion interactions. Here, we report ternary complexes of a ditopic nanographene tetraimide (1), α-substituted phthalocyanine (Pc), and polyaromatic hydrocarbons (PAHs) in solution and the crystalline state via allosteric regulation. Binding of one Pc gives rise to significant distortion and conformational changes in 1 that in turn lead to the inhibition of the second binding of Pc. The conformational changes associated with first binding allowed an allosteric binding of a third component (PAHs) to form ternary complexes in solution. 1H NMR titration revealed moderately high thermodynamic stability for the ternary complexes in CDCl3. Competition between allosterically regulated ternary complexes ([Pc·1·PAH]) and 1:2 stoichiometric binary complexes of 1 with PAHs ([PAH·1·PAH]) was elucidated. Further, the selective formation of ternary complexes in solution led to the generation of ternary cocrystals from a 1:1:1 mixture of three components in solution. Our work shows that large π-conjugated nanographenes designed with allosteric recognition sites allow the construction of multilayer ternary complexes in solution and the solid state even with dispersive π–π interactions.
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000617130 7001_ $$0P:(DE-H253)PIP1094122$$aShoyama, Kazutaka$$b1
000617130 7001_ $$0P:(DE-H253)PIP1094247$$aWuerthner, Frank$$b2$$eCorresponding author
000617130 77318 $$2Crossref$$3journal-article$$a10.1021/jacs.4c11119$$bAmerican Chemical Society (ACS)$$d2024-10-18$$n43$$p29728-29734$$tJournal of the American Chemical Society$$v146$$x0002-7863$$y2024
000617130 773__ $$0PERI:(DE-600)1472210-0$$a10.1021/jacs.4c11119$$gVol. 146, no. 43, p. 29728 - 29734$$n43$$p29728-29734$$tJournal of the American Chemical Society$$v146$$x0002-7863$$y2024
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