Ligand dynamics of drug-loaded microporous zirconium terephthalates-based metal-organic frameworks: Impact of the nature and concentration of the guest

Journal of Physical Chemistry C

Volumn 118, Issue 4, 2014, Pages 1983-1989

  Devautour Vinot, Sabine ^a   Diaby, Sekou ^b   Da Cunha, Denise ^c   Serre, Christian ^c   Horcajada, Patricia ^c   Maurin, Guillaume ^a  

^a UNIVERSITÉ DE MONTPELLIER   (France)

^b UNIVERSITÉ FÉLIX HOUPHOUËT BOIGNY   (Côte d’Ivoire)

^c UNIVERSITÉ DE VERSAILLES SAINT QUENTIN EN YVELINES   (France)

Author keywords

[No Author keywords available]

Indexed keywords

CHEMICAL FEATURES; DIELECTRIC RELAXATION SPECTROSCOPY; FUNCTIONALIZED; GLOBAL INTERACTION; METAL ORGANIC FRAMEWORK; QUALITATIVE ANALYSIS; ROTATIONAL MOTION; TEREPHTHALATE;

CRYSTALLINE MATERIALS; FUNCTIONAL GROUPS; LIGANDS; LOADING; MOLECULAR DYNAMICS; MOLECULES;

ZIRCONIUM;

EID: 84893219370     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp409753d     Document Type: Article

References (44)

1. Murray, L. J.; Dinca, M.; Long, J. R. Hydrogen Storage in Metal-Organic Frameworks Chem. Soc. Rev. 2009, 38, 1294-1313
2. Suh, M. P.; Park, H. J.; Prasad, T. K.; Lim, D. W. Hydrogen Storage in Metal-Organic Frameworks Chem. Rev. 2012, 112, 782-835
3. Sumida, K.; Rogow, D. L.; Mason, J. A.; McDonald, T. M.; Bloch, E. D.; Herm, Z. R.; Bae, T.-H.; Long, J. R. Carbon Dioxide Capture in Metal-Organic Frameworks Chem. Rev. 2012, 112, 724-784
4. Férey, G.; Serre, C.; Devic, T.; Maurin, G.; Jobic, H.; Llewellyn, P. L.; De Weireld, G.; Vimont, A.; Daturi, M.; Chang, J. S. Why Hybrid Porous Solids Capture Greenhouse Gases? Chem. Soc. Rev. 2011, 40, 550-562
5. Horcajada, P.; Gref, R.; Baati, T.; Allan, P. K.; Maurin, G.; Couvreur, P.; Férey, G.; Morris, R. E.; Serre, C. Metal-Organic Framework in Biomedecine Chem. Rev. 2012, 112, 1232-1268
6. Keskin, S.; Kizilel, S. Biomedical Applications of Metal Organic Frameworks Ind. Eng. Chem. Res. 2011, 50, 1799-1812
7. Della Rocca, J.; Liu, D. M.; Lin, W. B. Nanoscale Metal-Organic Frameworks for Biomedical Imaging and Drug Delivery Acc. Chem. Res. 2011, 44, 957-968
8. Imaz, I.; Rubio-Martinez, M.; An, J.; Sole-Font, I.; Rosi, N. L.; Maspoch, D. Metal-Biomolecule Frameworks (MBioFs) Chem. Commun. 2011, 47, 7287-7302
9. Stallmach, F.; Gröger, S.; Künzel, V.; Kärger, J.; Yaghi, O. M.; Hesse, M.; Müller, U. NMR Studies on the Diffusion of Hydrocarbons on the Metal-Organic Framework Material MOF-5 Angew. Chem., Int. Ed. 2006, 45, 2123-2126
10. 2 Mixtures in Covalent Organic Frameworks: Molecular Simulations and Theoretical Predictions J. Phys. Chem. C. 2012, 116, 1772-1779
11. Rosenbach, N.; Jobic, H.; Ghoufi, A.; Salles, F.; Maurin, G.; Bourrelly, S.; Llewellyn, P. L.; Devic, T.; Serre, C.; Férey, G. Quasi-Elastic Neutron Scattering and Molecular Dynamics Study of Methane Diffusion in Metal Organic Frameworks MIL-47(V) and MIL-53(Cr) Angew. Chem., Int. Ed. 2008, 47 (35) 6611-6615
12. Ford, D. C.; Dubbeldam, D.; Snurr, R. Q.; Künzel, V.; Wehring, M.; Stallmach, F.; Kärger, J.; Müller, U. Self Diffusion of Chain Molecules in the Metal-Organic Framework IRMOF-1: Simulation and Experiment J. Phys. Chem. Lett. 2012, 3 (7) 930-933
13. Amirjalayer, S.; Tafipolsky, M.; Schmid, R. Molecular Dynamics Simulation of Benzene Diffusion in MOF-5: Importance of Lattice Dynamics Angew. Chem., Int. Ed. 2007, 46, 463-466
14. Greathouse, J. A.; Allendorf, M. D. Force Field Validation for Molecular Dynamics Simulations of IRMOF-1 and Other Isoreticular Zinc Carboxylate Coordination Polymers J. Phys. Chem. C 2008, 112, 5795-5802
15. Seehamart, K. I.; Nanok, T.; Krishna, R.; van Baten, J. M.; Remsungnen, T.; Fritzsche, S. A Molecular Dynamics Investigation of the Influence of Framework Flexibility on Self-Diffusivity of Ethane in Zn(tbip) Frameworks Microporous Mesoporous Mater. 2009, 125, 97-100
16. Fairen-Jimenez, D.; Galvelis, R.; Torrisi, A. D.; Gellan, A.; Wharmby, M. T.; Wright, P. A.; Mellot-Draznieks, C.; Düren, T. Flexibility and Swing Effect on the Adsorption of Energy-Related Gases on ZIF-8: Combined Experimental and Simulation Study Dalton Trans. 2012, 41, 10752-10762
17. Chokbunpiam, T.; Chanajaree, R.; Saengsawang, O.; Reimann, S.; Chmelik, C.; Fritzsche, S.; Caro, J.; Remsungnen, T.; Hannongbua, S. The Importance of Lattice Flexibility fot the Migration of Ethane in ZIF-8: Molecular Dynamics Simulations Microporous Mesoporous Mater. 2013, 174, 126-134
18. 4 within the Porous Zirconium Terephthalate UiO-66(Zr): A Synergic Combination of Neutron Scattering Measurements and Molecular Simulations Chem.-Eur. J. 2011, 17, 8882-8889
19. Férey, G. Hybrid Porous Solids: Past, Present, Future Chem Soc. Rev. 2008, 37, 191-214
20. Férey, G.; Serre, C. Large Breathing Effects in Three-Dimensional Porous Hybrid Matter: Facts, Analyses, Rules and Consequences Chem. Soc. Rev. 2009, 38, 1380-1399
21. Zhou, W.; Yildirim, T. Lattice Dynamics of Metal-Organic Frameworks: Neutron Inelastic and First-Principles Calculations Phys. Rev. B 2006, 74, 180301
22. Winston, E. B.; Lowell, P. J.; Vacek, J.; Chocholousova, J.; Michl, J.; Price, J. C. Dipolar Molecular Rotors in the Metal-Organic Framework Crystal IRMOF-2 Phys. Chem. Chem. Phys. 2008, 10, 5188-5191
23. Vogelsberg, C. S.; Garcia-Garibay, M. A. Crystalline Molecular Machines: Function, Phase Order, Dimensionality and Composition Chem. Soc. Rev. 2012, 41, 1892-1910
24. Gould, S. L.; Tranchemontagne, D.; Yaghi, O. M.; Garcia-Garibay, M. A. Amphidynamic Character of Crystalline MOF-5: Rotational Dynamics of Terephthalate Phenylenes in a Free-Volume, Sterically Unhindered Environment J. Am. Chem. Soc. 2008, 130, 3246-3247
25. 2H NMR Spectroscopy Angew. Chem., Int. Ed. 2010, 49, 4791-4794
26. Shustova, N. B.; Ong, T. C.; Cozzolino, A. F.; Michaelis, V. K.; Griffin, R. G.; Dinca, M. Phenyl Ring Dynamics in a Tetraphenylethylene-Bridged Metal-Organic Framework: Implications for the Mechanism of Aggregation-Induced Emission J. Am. Chem. Soc. 2012, 134, 15061-15070
27. 2H NMR and Neutron Scattering J. Phys. Chem. C 2012, 116, 12131-12136
28. Morris, W.; Taylor, R. E.; Dybowski, C.; Yaghi, O. M.; Garcia-Garibay, M. A. Framework Mobility in the Metal-Organic Framework Crystal IRMOF-3: Evidence for Aromatic Ring and Amine Rotation J. Mol. Struct. 2011, 1004, 94-101
29. Kolokolov, D. I.; Jobic, H.; Stepanov, A. G.; Plazanet, M.; Zbiri, M.; Ollivier, J.; Guillerm, V.; Devic, T.; Serre, C.; Férey, G. Comparison of the Dynamics of MIL-53(Cr) and MIL-47(V) Frameworks Using Neutron Scattering and DFT Methods Eur. Phys. J., Spec. Top. 2010, 189, 263-271
30. Frunza, S.; Schönhals, A.; Frunza, L.; Ganea, P.; Kosslick, H.; Harloff, J.; Schulz, A. Molecular Relaxation Processes in a MOF-5 Structure Revealed by Broadband Dielectric Spectroscopy: Signature of Phenylene Ring Fluctuations J. Phys. Chem. B 2010, 114, 12840-12846
31. Devautour-Vinot, S.; Maurin, G.; Serre, C.; Horcajada, P.; da Cunha, D. P.; Guillerm, V.; de Souza Costa, E.; Taulelle, F.; Martineau, C. Structure and Dynamics of the Functionalized MOF type UiO-66(Zr): NMR and Dielectric Relaxation Spectroscopies Coupled with DFT Calculations Chem. Mater. 2012, 24, 2168-2177
32. Devautour-Vinot, S.; Martineau, C.; Sekou, D.; Ben Yahia, M.; Miller, S. R.; Serre, C.; Horcajada, P.; Cunha, D.; Taulelle, F.; Maurin, G. Caffeine Confinement into a Series of Functionalized Porous Zirconium MOFs: A Joint Experimental/Modelling Exploration J. Phys. Chem. C 2013, 117, 11654-11704
33. Horike, S.; Matsuda, R.; Tanaka, D.; Matsubara, S.; Mizuno, M.; Endo, K.; Kitagawa, S. Dynamic Motion of Building Blocks in Porous Coordination Polymers Angew. Chem. Int. Ed. 2006, 45, 7226-7230
34. Cavka, J. H.; Jakobsen, S.; Olsbye, U.; Guillou, N.; Lamberti, C.; Bordiga, S.; Lillerud, K. P. A New Zirconium Inorganic Building Brick Forming Metal Organic Frameworks with Exceptional Stability J. Am. Chem. Soc. 2008, 130, 13850-13851
35. Valenzano, L.; Civalleri, B.; Chavan, S.; Bordiga, S.; Nilsen, M. H.; Jakobsen, S.; Lillerud, K. P.; Lamberti, C. Disclosing the Complex Structure of UiO-66 Metal Organic Framework: A Synergic Combination of Experiment and Theory Chem. Mater. 2011, 23, 1700-1718
36. Brunyé, T. T.; Mahoney, C. R.; Lieberman, H. R.; Taylor, H. A. Caffeine Modulates Attention Network Function Brain Cognit. 2010, 72, 181-188
37. Glade, M. J. Caffeine-Not Just a Stimulant Nutrition 2010, 26, 932-938
38. Hexsel, D.; Orlandi, C.; Do Prado, D. Z. Botanical Extracts Used in the Treatment of Cellulite Dermatol. Surg. 2005, 31, 866-873
39. Goodman, L. S.; Gilman, A. The Pharmaceutical Bases of Therapeutics, 8 th ed.; Pergamon Press: New-York, 1990.
40. Cunha, D.; Gaudin, C.; Colinet, I.; Horcajada, P.; Maurin, G.; Serre, C. Rationalization of the Entrapping of Bioactive Molecules into a Series of Functionalized Porous Zirconium Terephthalate MOFs J. Mater. Chem. B 2013, 1, 1101-1108
41. Cunha, D.; Ben Yahia, M.; Hall, S.; Miller, S. R.; Chevreau, H.; Elkaïm, E.; Maurin, G.; Horcajada, P.; Serre, C. Rationale of Drug Encapsulation and Release from Biocompatible Porous Metal-Organic Frameworks Chem. Mater. 2013, 25, 2767-2776
42. Bras, A. R.; Merino, E. G.; Neves, P. D.; Fonseca, I. M.; Dionisio, M.; Schönhals, A.; Correia, N. T. Amorphous Ibuprofen Confined in Nanostructured Silica Materials: A Dynamical Approach J. Phys. Chem. C 2011, 115, 4616-4623
43. Bras, A. R.; Noronha, J. P.; Antunes, A. M. M.; Cardoso, M. M.; Schönhals, A.; Affouard, F.; Dionisio, M.; Correia, N. T. Molecular Motions in Amorphous Ibuprofen as Studied by Broadband Dielectric Spectroscopy J. Phys. Chem. B 2008, 112, 11087-11099
44. Comotti, A.; Bracco, S.; Valsesia, P.; Beretta, M.; Sozzani, P. Fast Molecular Rotor Dynamics Modulated by Guest Inclusion in a Highly Organized Nanoporous Organosilica Angew. Chem., Int. Ed. 2010, 49, 1760-1764