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| DOI | 10.1039/C3NJ00023K | ||||
| Año | 2013 | ||||
| Tipo | artículo de investigación |
Citas Totales
Autores Afiliación Chile
Instituciones Chile
% Participación
Internacional
Autores
Afiliación Extranjera
Instituciones
Extranjeras
In this work we report the structural and magnetic characterization of a new three-dimensional porous metal-organic framework (MOF) based on iron(III) and the formate anion, [Fe(HCO2)(3)](n)center dot nHCO(2)H (1), which was obtained by solvothermal synthesis. The tridimensional structure crystallizes in the trigonal space group R (3) over barc and is formed by highly regular octahedral Fe(OHCO)(6) units. These units contain six equal Fe-O distances, with angles slightly different from 90 degrees or 180 degrees. The packing of 1 corresponds to a 3D covalent network defined by face sharing between the parallelepipeds, which are formed by the interactions of Fe(OHCO)(6) units through formate ligands, thus generating a 4(12)6(3) topology. This topology contains channels in the three spatial directions, in which it is possible to find guest molecules of formic acid. The thermogravimetric analysis shows that 1 remains stable till 180 degrees C; after this temperature the decomposition of 1 begins. From a magnetic point of view, the reported MOF presents an antiferromagnetic behaviour in the 296 to 20 K range. The fit of the experimental data between room temperature and 50 K, using the high temperature series model (HTS model), permits us to estimate a J value of -1.01 cm(-1), which is in agreement with the reported values for analogous systems based on transition metal ions and formate ligands. Below this temperature, a weak ferromagnetism as a product of spin canting was observed due to the anti-anti coordination mode of the bridging ligand, which satisfies the requirement for Dzyaloshinsky-Moriya antisymmetric interactions between the Fe-III ions. The isothermal magnetization obtained at 2 K shows that the magnetization increases linearly with the applied magnetic field, reaching a value of 0.49N beta at the highest applied field of 50 kOe, indicating the antiferromagnetic character of the ground state. DFT calculations using a dinuclear fragment confirm the magnitude and nature of the magnetic phenomena of this extended system at high temperatures.
| Ord. | Autor | Género | Institución - País |
|---|---|---|---|
| 1 | PAREDES-GARCIA, VERONICA DEL ROSARIO | Mujer |
Universidad Nacional Andrés Bello - Chile
Centro para el Desarrollo de la Nanociencia y la Nanotecnologia - Chile |
| 2 | Rojas, Ignacio | Hombre |
Centro para el Desarrollo de la Nanociencia y la Nanotecnologia - Chile
|
| 3 | Madrid, Rosa | Mujer |
Centro para el Desarrollo de la Nanociencia y la Nanotecnologia - Chile
|
| 4 | VEGA-CARVALLO, ANDRES IGOR | Hombre |
Universidad Nacional Andrés Bello - Chile
Centro para el Desarrollo de la Nanociencia y la Nanotecnologia - Chile |
| 5 | Navarro-Moratalla, Efren | Hombre |
Univ Valencia - España
University of Valencia - España Universitat de València - España |
| 6 | CANON-MANCISIDOR, WALTER ALBERTO | Hombre |
Universidad de Chile - Chile
Centro para el Desarrollo de la Nanociencia y la Nanotecnologia - Chile |
| 7 | SPODINE-SPIRIDONOVA, EVGENIA | Mujer |
Universidad de Chile - Chile
Centro para el Desarrollo de la Nanociencia y la Nanotecnologia - Chile |
| 8 | VENEGAS-YAZIGI, DIEGO ALONSO | Hombre |
Universidad de Santiago de Chile - Chile
Centro para el Desarrollo de la Nanociencia y la Nanotecnologia - Chile |
| Fuente |
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| FONDECYT |
| NLHPC, Center for Mathematical Modeling CMM, Universidad de Chile |
| Proyecto Basal CEDENNA, Financiamiento Basal |
| Agradecimiento |
|---|
| The authors acknowledge financial support from FONDECYT 1090477 and Proyecto Basal CEDENNA, Financiamiento Basal FB0807. Powered@NLHPC: this research was partially supported by the supercomputing infrastructure of the NLHPC (ECM-02), Center for Mathematical Modeling CMM, Universidad de Chile. |