Search results for "IC framework"
showing 10 items of 268 documents
Elucidating Gating Effects for Hydrogen Sorption in MFU-4-Type Triazolate-Based Metal-Organic Frameworks Featuring Different Pore Sizes
2011
A highly porous member of isoreticular MFU-4-type frameworks, [Zn(5)Cl(4)(BTDD)(3)] (MFU-4l(arge)) (H(2)-BTDD=bis(1H-1,2,3-triazolo[4,5-b],[4',5'-i])dibenzo[1,4]dioxin), has been synthesized using ZnCl(2) and H(2)-BTDD in N,N-dimethylformamide as a solvent. MFU-4l represents the first example of MFU-4-type frameworks featuring large pore apertures of 9.1 Å. Here, MFU-4l serves as a reference compound to evaluate the origin of unique and specific gas-sorption properties of MFU-4, reported previously. The latter framework features narrow-sized pores of 2.5 Å that allow passage of sufficiently small molecules only (such as hydrogen or water), whereas molecules with larger kinetic diameters (e.…
A tris-oxovanadium pyrogallate complex: synthesis, structure, and magnetic and electronic properties
2021
International audience; With the aim of identifying new cation-phenolate complexes, we herein investigated the reactivity of pyrogallol (H(3)pgal) with vanadium salts. A trimetallic anionic complex was identified, and found to be formed under a broad set of reaction conditions. This complex, with the formula V3O3(pgal)(3)(3-), consists of three oxovanadium(iv) units connected together by three pyrogallate ligands to afford a bowl-shaped species presenting a pseudo 3-fold symmetry axis. Its crystal structure is reported, as well as its characterisation by a broad set of techniques, including powder X-ray diffraction, thermogravimetric analysis, infrared and Raman spectroscopy, and solid stat…
Coordination Driven Capture of Nicotine Inside a Mesoporous MOF.
2017
Metal organic frameworks (MOFs) are a wide class of crystalline porous polymers studied in many fields, ranging from catalysis to gas storage. In the past few years, MOFs have been studied for the encapsulation of organic or organometallic molecules and for the development of potential drug carriers. Here, we report on the study of two structurally-related mesoporous Cu-MOFs, namely PCN-6 and PCN-6′ (PCN stands for Porous Coordination Network), for nicotine trapping. Nicotine is a well-known alkaloid liquid molecule at room temperature, whose crystalline structure is still unknown. In this work, the loading process was monitored by electron ionization mass spectrometry by using a direct ins…
Ti-based robust MOFs in the combined photocatalytic degradation of emerging organic contaminants.
2022
Photocatalysis process is a promising technology for environmental remediation. In the continuous search of new heterogeneous photocatalysts, metal–organic frameworks (MOFs) have recently emerged as a new type of photoactive materials for water remediation. Particularly, titaniumbased MOFs (Ti-MOFs) are considered one of the most appealing subclass of MOFs due to their promising optoelectronic and photocatalytic properties, high chemical stability, and unique structural features. However, considering the limited information of the reported studies, it is a hard task to determine if real-world water treatment is attainable using Ti-MOF photocatalysts. In this paper, via a screening with seve…
Extension theory and the calculus of butterflies
2016
Abstract This paper provides a unified treatment of two distinct viewpoints concerning the classification of group extensions: the first uses weak monoidal functors, the second classifies extensions by means of suitable H 2 -actions. We develop our theory formally, by making explicit a connection between (non-abelian) G-torsors and fibrations. Then we apply our general framework to the classification of extensions in a semi-abelian context, by means of butterflies [1] between internal crossed modules. As a main result, we get an internal version of Dedecker's theorem on the classification of extensions of a group by a crossed module. In the semi-abelian context, Bourn's intrinsic Schreier–M…
Biodesign for conformational adaptability and guest recognition in crystalline frameworks
2021
La presente tesis doctoral ha sido realizada como compendio de publicaciones y lleva por título “Biodiseño en adaptabilidad conformacional y reconocimiento de huéspedes en estructuras cristalinas” (Biodesign for conformational adaptability and guest recognition in crystalline frameworks). Se encuentra dividida en cuatro capítulos con unas conclusiones finales y resumen en castellano. El primer capítulo se trata de una introducción a las redes metal-orgánicas (MOFs) basados en materiales biológicos, tanto su diseño a partir de éstos, como algunas de sus aplicaciones más notables. Inicialmente se habla del origen de este tipo de sistemas, que radica en la necesidad que tenían los químicos hac…
Stimuli-responsive magnetic coordination polymers: from crystals to nanoparticles
2013
El trabajo descrito en esta tesis se enmarca en el ámbito de los polímeros de coordinación (PC). Estos sistemas representan un área importante dentro de la Química de los Materiales, siendo principalmente interesantes sus aplicaciones en catálisis, electrónica y óptica. Su origen data de principios de los años 60, donde se produjo la primera revisión de estructuras de compuestos inorgánicos que formaban cadenas.1 Los PC están formados por ligandos orgánicos y metales enlazados por enlaces de coordinación que se extienden infinitamente en 1, 2 o 3 dimensiones. En cuanto a su versatilidad química, las estructuras y propiedades varían en función de los metales o ligandos utilizados. Así pues, …
Exploring chemical complexity in group IV reticular solids
2022
Esta tesis aborda el reto de ampliar las herramientas sintéticas disponibles para aumentar la complejidad química de los materiales reticulares basados en metales del grupo IV, dirigiéndose tanto a la parte orgánica como a la inorgánica de estos materiales porosos e híbridos. El capítulo 1 ofrece una visión del aumento de la complejidad química en los sólidos reticulares, que proporciona un contexto general a los resultados desarrollados durante esta tesis. A continuación, la introducción de la variación química en los conectores orgánicos se describe en los capítulos 2, 3 y 4, mientras que la transformación química de los nodos inorgánicos se introduce en el capítulo 5. Todo el trabajo des…
Water Adsorption in Flexible Gallium-Based MIL-53 Metal–Organic Framework
2014
Understanding the adsorption of water in metal–organic frameworks (MOF), and particularly in soft porous crystals, is a crucial prerequisite before considering MOFs for industrial applications. We report here a joint experimental and theoretical study on the behavior of a gallium-based breathing MOF, Ga-MIL-53, upon water adsorption. By looking at the energetics and thermodynamics of Ga-MIL-53, we demonstrate why it behaves differently from its sibling Al-MIL-53, showing a different phase at room temperature (a nonporous phase) and the presence of a hydrated narrow-pore structure at gas saturation pressure. Moreover, we present a complete water vapor pressure vs temperature phase diagram of…
Cyanido-Bridged FeII-MI Dimetallic Hofmann-Like Spin-Crossover Coordination Polymers Based on 2,6-Naphthyridine
2017
[EN] Two new 3D spin-crossover (SCO) Hofmann-type coordination polymers {Fe(2,6-naphthy)[Ag(CN)2][Ag2(CN)3]} (1; 2,6-naphthy = 2,6-naphthyridine) and {Fe(2,6-naphthy)- [Au(CN)2]2}·0.5PhNO2 (2) were synthesized and characterized. Both derivatives are made up of infinite stacks of {Fe[Ag(CN)2]2- [Ag2(CN)3]}n and {Fe[Au(CN)2]2}n layered grids connected by pillars of 2,6-naphthy ligands coordinated to the axial positions of the FeII centers of alternate layers.