A three-shell supramolecular complex enables the symmetry-mismatched chemo- and regioselective bis-functionalization of C


Journal

Nature chemistry
ISSN: 1755-4349
Titre abrégé: Nat Chem
Pays: England
ID NLM: 101499734

Informations de publication

Date de publication:
05 2021
Historique:
received: 15 03 2020
accepted: 05 02 2021
pubmed: 17 4 2021
medline: 17 4 2021
entrez: 16 4 2021
Statut: ppublish

Résumé

Molecular Russian dolls (matryoshkas) have proven useful for testing the limits of preparative supramolecular chemistry but applications of these architectures to problems in other fields are elusive. Here we report a three-shell, matryoshka-like complex-in which C

Identifiants

pubmed: 33859394
doi: 10.1038/s41557-021-00658-6
pii: 10.1038/s41557-021-00658-6
doi:

Types de publication

Journal Article Research Support, Non-U.S. Gov't

Langues

eng

Sous-ensembles de citation

IM

Pagination

420-427

Références

He, Y. & Li, Y. Fullerene derivative acceptors for high performance polymer solar cells. Phys. Chem. Chem. Phys. 13, 1970–1983 (2011).
pubmed: 21180723 doi: 10.1039/C0CP01178A
Mishra, A. & Bäuerle, P. Small molecule organic semiconductors on the move: promises for future solar energy technology. Angew. Chem. Int. Ed. 51, 2020–2067 (2012).
doi: 10.1002/anie.201102326
Mazzio, K. A. & Luscombe, C. K. The future of organic photovoltaics. Chem. Soc. Rev. 44, 78–90 (2015).
pubmed: 25198769 doi: 10.1039/C4CS00227J
Ragoussi, M.-E. & Torres, T. New generation solar cells: concepts, trends and perspectives. Chem. Commun. 51, 3957–3972 (2015).
doi: 10.1039/C4CC09888A
Inganäs, O. Organic photovoltaics over three decades. Adv. Mater. 30, 1800388 (2018).
doi: 10.1002/adma.201800388
Deng, L.-L., Xie, S.-Y. & Gao, F. Fullerene-based materials for photovoltaic applications: toward efficient, hysteresis-free, and stable perovskite solar cells. Adv. Electron. Mater. 4, 1700435 (2018).
doi: 10.1002/aelm.201700435
Muñoz, A. et al. Synthesis of giant globular multivalent glycofullerenes as potent inhibitors in a model of Ebola virus infection. Nat. Chem. 8, 50–57 (2015).
doi: 10.1038/nchem.2387
Nierengarten, J.-F. et al. Giant glycosidase inhibitors: first- and second-generation fullerodendrimers with a dense iminosugar shell. Chem. Eur. J. 24, 2483–2492 (2018).
pubmed: 29281149 doi: 10.1002/chem.201705600
Hirsch, A. & Brettreich, M. Fullerenes, Chemistry and Reactions (Wiley-VCH, 2005).
Fuertes-Espinosa, C., Pujals, M. & Ribas, X. Supramolecular purification and regioselective functionalization of fullerenes and endohedral metallofullerenes. Chem 6, 3219–3262 (2020).
doi: 10.1016/j.chempr.2020.11.003
Djojo, F., Herzog, A., Lamparth, I., Hampel, F. & Hirsch, A. Regiochemistry of twofold additions to [6,6] bonds in C
doi: 10.1002/chem.19960021211
Hirsch, A., Lamparth, I. & Karfunkel, H. R. Fullerene chemistry in three dimensions: isolation of seven regioisomeric bisadducts and chiral trisadducts of C
doi: 10.1002/anie.199404371
Lenes, M. et al. Fullerene bisadducts for enhanced open-circuit voltages and efficiencies in polymer solar cells. Adv. Mater. 20, 2116–2119 (2008).
doi: 10.1002/adma.200702438
Shi, W. et al. Purification and electronic characterisation of 18 isomers of the OPV acceptor material bis-[60]PCBM. Chem. Commun. 53, 975–978 (2017).
doi: 10.1039/C6CC07820F
Cao, T. et al. Towards a full understanding of regioisomer effects of indene-C
doi: 10.1039/C7TA01665D
Zhang, F. et al. Isomer-pure bis-PCBM-assisted crystal engineering of perovskite solar cells showing excellent efficiency and stability. Adv. Mater. 29, 1606806 (2017).
doi: 10.1002/adma.201606806
Umeyama, T. & Imahori, H. Isomer effects of fullerene derivatives on organic photovoltaics and perovskite solar cells. Acc. Chem. Res. 52, 2046–2055 (2019).
pubmed: 31318521 doi: 10.1021/acs.accounts.9b00159
Isaacs, L., Diederich, F. & Haldimann, R. F. Multiple adducts of C
doi: 10.1002/hlca.19970800202
Isaacs, L., Haldimann, R. F. & Diederich, F. Tether-directed remote functionalization of buckminsterfullerene: regiospecific hexaadduct formation. Angew. Chem. Int. Ed. 33, 2339–2342 (1994).
doi: 10.1002/anie.199423391
Ðorđević, L. et al. Light-controlled regioselective synthesis of fullerene bis-adducts. Angew. Chem. Int. Ed. 60, 313–320 (2021).
doi: 10.1002/anie.202009235
Qian, W. & Rubin, Y. Complete control over addend permutation at all six pseudooctahedral positions of fullerene C
doi: 10.1021/ja001795c
Beuerle, F. & Hirsch, A. Synthesis and orthogonal functionalization of [60]fullerene e,e,e-trisadducts with two spherically defined addend zones. Chem. Eur. J. 15, 7434–7446 (2009).
pubmed: 19551780 doi: 10.1002/chem.200900329
Beuerle, F., Chronakis, N. & Hirsch, A. Regioselective synthesis and zone selective deprotection of [60]fullerene tris-adducts with an e,e,e addition pattern. Chem. Commun. 3676–3678 (2005).
Kräutler, B. et al. A topochemically controlled, regiospecific fullerene bisfunctionalization. Angew. Chem. Int. Ed. 35, 1204–1206 (1996).
doi: 10.1002/anie.199612041
Schwenninger, R., Müller, T. & Kräutler, B. Concise route to symmetric multiadducts of [60]fullerene: preparation of an equatorial tetraadduct by orthogonal transposition. J. Am. Chem. Soc. 119, 9317–9318 (1997).
doi: 10.1021/ja971875p
Ortiz, A. L. & Echegoyen, L. Unexpected and selective formation of an (e,e,e,e)-tetrakis-[60]fullerene derivative via electrolytic retro-cyclopropanation of a D
doi: 10.1039/C0JM00754D
Hörmann, F., Donaubauer, W., Hampel, F. & Hirsch, A. Efficient synthesis of C
pubmed: 22307726 doi: 10.1002/chem.201102638
Yoshizawa, M., Klosterman, J. K. & Fujita, M. Functional molecular flasks: new properties and reactions within discrete, self-assembled hosts. Angew. Chem. Int. Ed. 48, 3418–3438 (2009).
doi: 10.1002/anie.200805340
Brenner, W., Ronson, T. K. & Nitschke, J. R. Separation and selective formation of fullerene adducts within an M
pubmed: 27997149 doi: 10.1021/jacs.6b11523
Huang, N. et al. Tailor-made pyrazolide-based metal–organic frameworks for selective catalysis. J. Am. Chem. Soc. 140, 6383–6390 (2018).
pubmed: 29719956 doi: 10.1021/jacs.8b02710
Chen, B., Holstein, J. J., Horiuchi, S., Hiller, W. G. & Clever, G. H. Pd(II) coordination sphere engineering: pyridine cages, quinoline bowls, and heteroleptic pills binding one or two fullerenes. J. Am. Chem. Soc. 141, 8907–8913 (2019).
pubmed: 31067401 pmcid: 6609009 doi: 10.1021/jacs.9b02207
Leonhardt, V., Fimmel, S., Krause, A.-M. & Beuerle, F. A covalent organic cage compound acting as a supramolecular shadow mask for the regioselective functionalization of C
doi: 10.1039/D0SC03131C
Bottari, G. et al. Regio-, stereo-, and atropselective synthesis of C
doi: 10.1002/anie.201602713
Iwamoto, T., Watanabe, Y., Sadahiro, T., Haino, T. & Yamago, S. Size-selective encapsulation of C
doi: 10.1002/anie.201102302
Xia, J., Bacon, J. W. & Jasti, R. Gram-scale synthesis and crystal structures of [8]- and [10]CPP, and the solid-state structure of C
doi: 10.1039/c2sc20719b
Xu, Y. et al. A supramolecular [10]CPP junction enables efficient electron transfer in modular porphyrin–[10]CPP⊃fullerene complexes. Angew. Chem. Int. Ed. 57, 11549–11553 (2018).
doi: 10.1002/anie.201802443
Rio, J. et al. Electronic communication between two [10]cycloparaphenylenes and bis(azafullerene) (C
doi: 10.1002/anie.201713197
Xu, Y. & von Delius, M. The supramolecular chemistry of strained carbon nanohoops. Angew. Chem. Int. Ed. 59, 559–573 (2020).
doi: 10.1002/anie.201906069
Xu, Y. et al. Concave–convex π–π template approach enables the synthesis of [10]cycloparaphenylene–fullerene [2]rotaxanes. J. Am. Chem. Soc. 140, 13413–13420 (2018).
pubmed: 30234982 doi: 10.1021/jacs.8b08244
Fuertes-Espinosa, C. et al. Supramolecular fullerene sponges as catalytic masks for regioselective functionalization of C
doi: 10.1016/j.chempr.2019.10.010
Kawase, T., Tanaka, K., Shiono, N., Seirai, Y. & Oda, M. Onion-type complexation based on carbon nanorings and a buckminsterfullerene. Angew. Chem. Int. Ed. 43, 1722–1724 (2004).
doi: 10.1002/anie.200353517
Rousseaux, S. A. L. et al. Self-assembly of Russian doll concentric porphyrin nanorings. J. Am. Chem. Soc. 137, 12713–12718 (2015).
pubmed: 26378660 pmcid: 4655919 doi: 10.1021/jacs.5b07956
Cai, K. et al. Molecular Russian dolls. Nat. Commun. 9, 5275 (2018).
pubmed: 30531970 pmcid: 6288134 doi: 10.1038/s41467-018-07673-1
Zhang, D. et al. Enantiopure [Cs
pubmed: 31034215 doi: 10.1021/jacs.9b02866
García-Simón, C. et al. Sponge-like molecular cage for purification of fullerenes. Nat. Commun. 5, 5557 (2014).
pubmed: 25424201 doi: 10.1038/ncomms6557
Fuertes-Espinosa, C. et al. Purification of uranium-based endohedral metallofullerenes (EMFs) by selective supramolecular encapsulation and release. Angew. Chem. Int. Ed. 57, 11294–11299 (2018).
doi: 10.1002/anie.201806140
Park, K. et al. Synthesis of symmetrical and unsymmetrical diarylalkynes from propiolic acid using palladium-catalyzed decarboxylative coupling. J. Org. Chem. 75, 6244–6251 (2010).
pubmed: 20795634 doi: 10.1021/jo101398a
Brynn Hibbert, D. & Thordarson, P. The death of the Job plot, transparency, open science and online tools, uncertainty estimation methods and other developments in supramolecular chemistry data analysis. Chem. Commun. 52, 12792–12805 (2016).
doi: 10.1039/C6CC03888C
Thordarson, P. Determining association constants from titration experiments in supramolecular chemistry. Chem. Soc. Rev. 40, 1305–1323 (2011).
pubmed: 21125111 doi: 10.1039/C0CS00062K
Thordarson, P. et al. Allosterically driven multicomponent assembly. Angew. Chem. Int. Ed. 43, 4755–4759 (2004).
doi: 10.1002/anie.200460398
Rizzuto, F. J. & Nitschke, J. R. Stereochemical plasticity modulates cooperative binding in a CoII12L6 cuboctahedron. Nat. Chem. 9, 903–908 (2017).
pubmed: 28837174 doi: 10.1038/nchem.2758
García-Simón, C. et al. Complete dynamic reconstruction of C
pubmed: 32822170 doi: 10.1021/jacs.0c07591
Dannhäuser, J. et al. σ-donor and π-acceptor stacking interactions in a trans-2-linked C
doi: 10.1002/anie.200504383
Matsuno, T., Nakai, Y., Sato, S., Maniwa, Y. & Isobe, H. Ratchet-free solid-state inertial rotation of a guest ball in a tight tubular host. Nat. Commun. 9, 1907 (2018).
pubmed: 29765050 pmcid: 5954156 doi: 10.1038/s41467-018-04325-2
Mecozzi, S. & Rebek, J. J. The 55% solution: a formula for molecular recognition in the liquid state. Chem. Eur. J. 4, 1016–1022 (1998).
doi: 10.1002/(SICI)1521-3765(19980615)4:6<1016::AID-CHEM1016>3.0.CO;2-B

Auteurs

Ernest Ubasart (E)

Institut de Química Computacional i Catàlisi and Departament de Química, Universitat de Girona, Girona, Spain.

Oleg Borodin (O)

Institute of Organic Chemistry, Ulm University, Ulm, Germany.

Carles Fuertes-Espinosa (C)

Institut de Química Computacional i Catàlisi and Departament de Química, Universitat de Girona, Girona, Spain.

Youzhi Xu (Y)

Institute of Organic Chemistry, Ulm University, Ulm, Germany.

Cristina García-Simón (C)

Institut de Química Computacional i Catàlisi and Departament de Química, Universitat de Girona, Girona, Spain.

Laura Gómez (L)

Serveis Tècnics de Recerca, Universitat de Girona, Girona, Spain.

Judith Juanhuix (J)

ALBA Synchrotron, Cerdanyola del Vallès, Spain.

Felipe Gándara (F)

Materials Science Institute of Madrid, Spanish National Research Council, Madrid, Spain.

Inhar Imaz (I)

Catalan Institute of Nanoscience and Nanotechnology, CSIC and The Barcelona Institute of Science and Technology, Barcelona, Spain.

Daniel Maspoch (D)

Catalan Institute of Nanoscience and Nanotechnology, CSIC and The Barcelona Institute of Science and Technology, Barcelona, Spain.
ICREA, Barcelona, Spain.

Max von Delius (M)

Institute of Organic Chemistry, Ulm University, Ulm, Germany. max.vondelius@uni-ulm.de.

Xavi Ribas (X)

Institut de Química Computacional i Catàlisi and Departament de Química, Universitat de Girona, Girona, Spain. xavi.ribas@udg.edu.

Classifications MeSH