Category: Miquel Costas news

PhD defense Adrià López

Tomorrow (28th of July, 12h, Sala de Graus, Facultat de Ciències) will take place the defense of the doctoral thesis of Adrián López titled “Aplicación de la técnica GPC al análisis de polímeros de interés industrial ” supervised by Miquel Costas from IQCC and Josep Nadal from Concentrol. We wish him good luck and all

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Rational Design of Bioinspired Catalysts for Selective Oxidations

The ubiquity and relevance of oxygenated motifs in biologically active compounds calls for the development of effective and selective C-H and C=Coxidation reactions. Inspired by the impressive selectivity and versatility of Nature oxidation catalysts, and especially nonheme Fe oxygenases, chemists have designed small molecule catalysts that can hydroxylate C-H bonds and epoxidize or syn-di-hydroxylate C=C bonds with

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Predictable selectivity in remote C-H oxidation of steroids via analysis of substrate binding mode

Predictability is a key requirement to encompass late-stage C-H functionalization in synthetic routes. However, prediction (and control) of reaction selectivity is usually challenging, especially for complex substrate structures and elusive transformations such as remote C( sp 3 )-H oxidation, as it requires to distinguish a specific C-H bond from many others with similar reactivity. Herein,

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ERC Advanced Grant for Miquel Costas

Today the European Research Council announced the grantees of their ERC Advanced Grants, among which featured our Miquel Costas (ICREA Academia) with his “Enantioselective C-H Oxidation Guided by Rational Catalyst Design” project. This five-year project will enable him to continue on his excellent path to understanding in great detail the secrets of C-H oxidation chemistry. Congratulations

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Site-Selective and Product Chemoselective Aliphatic C–H Bond Hydroxylation

Site-selective and product chemoselective aliphatic C–H bond oxidation of 1,2-diols and of polyhydroxylated substrates using iron and manganese catalysts and hydrogen peroxide as terminal oxidant is described. The reaction capitalizes on the use of fluorinated alcohol solvents such as 2,2,2-trifluoroethanol (TFE) and 1,1,1,3,3,3-hexafluoro-2-propanol (HFIP), which exert a strong polarity reversal in the hydroxyl moieties of

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IQCC reaches milestone of h=100

The IQCC was created in 1993 (as IQC, focusing only on computational chemistry), and was joined in 2013 by two experimental groups (QBIS, METSO) because of long-standing collaborations and mutual interests. Right now, in this vibrant community of highly motivated researchers that are working on predictive catalysis both at lab benches and through molecular modelling, we

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Enantioselective C-H lactonization of unactivated methylenes directed by carboxylic acids

The formidable challenges of controlling site-selectivity, enantioselectivity and product chemoselectivity, make asymmetric C-H oxidation a generally unsolved problem for non-enzymatic systems. Discrimination between the two enantiotopic C-H bonds of an unactivated methylenic group is particularly demanding and so far unprecedented, given the similarity between their environments and the facile overoxidation of the initially formed hydroxylation

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Supramolecular Fullerene Sponges as Catalytic Masks for Regioselective Functionalization of C60

Isomer-pure poly-functionalized fullerenes are required to boost the development of fullerene chemistry in all fields. On a general basis, multi-adduct mixtures with uncontrolled regioselectivity are obtained, and the use of chromatographic purification is prohibitively costly and time consuming, especially in the production of solar cells. Single-isomer poly-functionalized fullerenes are only accessible via stoichiometric, multistep paths

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PhD defense Mònica Rodriguez

Next Friday (27th of September, 11.00h, Aula Magna, Facultat de Ciències) will take place the defense of the doctoral thesis of Mònica Rodriguez titled “First row transition metal carbenes: from supporting ligands to organic reactive fragments” supervised by Dr Miquel Costas and Dr. Alberto Hernán-Gómez from IQCC. We wish her good luck and all the

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Spectroscopy and reactivity of Fe(IV) and Fe(V) species with one ligand

This work directly compares the spectroscopic and reactivity properties of an oxoiron(IV) and an oxoiron(V) complex that are supported by the same neutral tetradentate N-based PyNMe3 ligand. A complete spectroscopic characterization of the oxoiron(IV) species (2) reveals that this compound exists as a mixture of two isomers. The reactivity of the thermodynamically more stable oxoiron(IV)

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