New Beatriu de Pinñs, Marc Garcia-Borr s

Dr. Marc Garcia-Borr s has been selected as Beatriu de Pinñs researcher of the Institute of Computational Chemistry New Beatriu de Pinñs, Marc Garcia-Borr s

Organic Letters cover on synthesis of polycyclic hereocycles

A novel methodology to transform bisallenes into a variety of polycyclic derivatives employing rhodium(I) catalysis has been developed. Organic Letters cover on synthesis of polycyclic hereocycles

Verñnica Postils wins RSEQ prize for best paper 2018 in Computational Chemistry

Former member Verñnica Postils has been awarded best paper 2018 in Computational Chemistry prize given by the Computational Verñnica Postils wins RSEQ prize for best paper 2018 in Computational Chemistry

Miquel Sol elected Honorary Member of Polish Chemical Society

On the opening ceremony of the 62nd Annual Meeting of the Polish Chemical Society, organized on 2-6 September Miquel Sol elected Honorary Member of Polish Chemical Society

Computer-aided design of chemical catalysts and enzymes

Making chemical reactions faster or more selective can be achieved by catalysts, which can be biomolecular enzymes or Computer-aided design of chemical catalysts and enzymes

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

Octahedral iron(IV)-tosylimido complexes exhibiting single electron-oxidation reactivity

High valent iron species are very reactive molecules involved in oxidation reactions of relevance to biology and chemical Octahedral iron(IV)-tosylimido complexes exhibiting single electron-oxidation reactivity

Former IQCC member awarded for best PhD thesis 2018

Yesterday, our former member of IQCC Oriol Planas was awarded the Premi Extraordinari for the best PhD thesis Former IQCC member awarded for best PhD thesis 2018

Selective functionalization of non-activated aliphatic C-H bonds

Combining an electrophilic iron complex [Fe(Fpda)(THF)]2 (3) [Fpda=N,N’-bis(pentafluorophenyl)-o-phenylenediamide] with the pre-activation of a-alkyl-substituted a-diazoesters reagents by LiAl(ORF)4 [ORF=(OC(CF3)3] Selective functionalization of non-activated aliphatic C-H bonds

Allosterically driven conformational ensemble in tryptophan synthase evolution

Multimeric enzyme complexes are ubiquitous in nature and catalyze a broad range of useful biological transformations. They are Allosterically driven conformational ensemble in tryptophan synthase evolution