Please use this identifier to cite or link to this item: https://hdl.handle.net/10356/93946
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dc.contributor.authorMiljanić, Ognjen Š.en
dc.contributor.authorKnobler, Carolyn B.en
dc.contributor.authorYaghi, Omar M.en
dc.contributor.authorLi, Qiaoweien
dc.contributor.authorZhang, Wenyuen
dc.contributor.authorSue, Chi Hauen
dc.contributor.authorZhao, Yanlien
dc.contributor.authorLiu, Lihuaen
dc.contributor.authorStoddart, J. Fraseren
dc.date.accessioned2011-08-12T06:05:42Zen
dc.date.accessioned2019-12-06T18:48:18Z-
dc.date.available2011-08-12T06:05:42Zen
dc.date.available2019-12-06T18:48:18Z-
dc.date.copyright2009en
dc.date.issued2009en
dc.identifier.citationLi, Q., Zhang, W., Miljanić, O. Š., Sue, C. H., Zhao, Y. L., Liu, L., et al. (2009). Docking in Metal-Organic Frameworks. Science, 325, 855-859.en
dc.identifier.urihttps://hdl.handle.net/10356/93946-
dc.description.abstractThe use of metal-organic frameworks (MOFs) so far has largely relied on nonspecific binding interactions to host small molecular guests. We used long organic struts (~2 nanometers) incorporating 34- and 36-membered macrocyclic polyethers as recognition modules in the construction of several crystalline primitive cubic frameworks that engage in specific binding in a way not observed in passive, open reticulated geometries. MOF-1001 is capable of docking paraquat dication (PQT2+) guests within the macrocycles in a stereoelectronically controlled fashion. This act of specific complexation yields quantitatively the corresponding MOF-1001 pseudorotaxanes, as confirmed by x-ray diffraction and by solid- and solution-state nuclear magnetic resonance spectroscopic studies performed on MOF-1001, its pseudorotaxanes, and their molecular strut precursors. A control experiment involving the attempted inclusion of PQT2+ inside a framework (MOF-177) devoid of polyether struts showed negligible uptake of PQT2+, indicating the importance of the macrocyclic polyether in PQT2+ docking.en
dc.format.extent6 p.en
dc.language.isoenen
dc.relation.ispartofseriesScienceen
dc.rights© 2009 American Association for the Advancement of Science. This is the author created version of a work that has been peer reviewed and accepted for publication by Science, American Association for the Advancement of Science.  It incorporates referee’s comments but changes resulting from the publishing process, such as copyediting, structural formatting, may not be reflected in this document.  The published version is available at: http://dx.doi.org/10.1126/science.1175441.en
dc.subjectDRNTU::Science::Chemistry::Organic chemistry::Organometallic compoundsen
dc.titleDocking in metal-organic frameworksen
dc.typeJournal Articleen
dc.contributor.schoolSchool of Physical and Mathematical Sciencesen
dc.identifier.doi10.1126/science.1175441en
dc.description.versionAccepted versionen
dc.identifier.rims159760en
item.grantfulltextopen-
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