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Visualization and Manipulation of Solid-State Molecular Motions in Cocrystallization Processes

Haoran Wang, Qiyao Li, Jianyu Zhang, Haoke Zhang, Yuanhong Shu, Zheng Zhao, Wei Jiang, Lili Du, David Lee Phillips, Jacky W. Y. Lam, Herman H. Y. Sung, Ian D. Williams, Ran Lu, Ben Zhong Tang

2021Journal of the American Chemical Society94 citationsDOI

Abstract

Solid-state molecular motions (SSMM) play a critical role in adjusting behaviors and properties of materials. However, research on SSMM, especially for multicomponent systems, suffers from various problems and is rarely explored. Herein, through collaboration with cocrystal engineering, visualization and manipulation of SSMM in two-component systems, namely, FSBO ((E)-2-(4-fluorostyryl)benzo[d]oxazole)/TCB (1,2,4,5-tetracyanobenzene) and PVBO ((E)-2-(2-(pyridin-4-yl)vinyl)benzo[d]oxazole)/TCB, were realized. The obtained yellow-emissive F/T (FSBO/TCB) cocrystal displayed turn-on fluorescence, and the green-emissive P/T (PVBO/TCB) cocrystal presented redder emission, both of which exhibited an aggregation-induced emission property. At varied pressure and temperature, the grinding mixtures of FSBO/TCB and PVBO/TCB displayed different molecular motions that were readily observed through the fluorescence signal. Notably, even without grinding, FSBO and TCB molecules could move over for 4 mm in a 1D tube. The unique emission changes induced by SSMM were applied in information storage and dynamic anticounterfeiting. This work not only visualized and manipulated SSMM but offered more insights for multicomponent study in aggregate science.

Topics & Concepts

CocrystalChemistryGrindingFluorescenceAggregation-induced emissionOxazoleVisualizationMoleculeMetastabilitySolid-stateNanotechnologyStereochemistryPhysical chemistryOrganic chemistryOpticsMechanical engineeringComputer sciencePhysicsHydrogen bondMaterials scienceEngineeringArtificial intelligenceLuminescence and Fluorescent MaterialsCrystallography and molecular interactionsMolecular Sensors and Ion Detection
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