Catalytic Methods for Sustainable Synthesis. A Merged Experimental and Computational Approach

Deliverables

Other (13)

Workshop 5

Training Activities-Workshop 5: The Application of Flow Chemistry in Industry. This WS will be organised in collaboration with AZ.

Workshop 2

Training Activities -Workshop 2: Introduction to computational drug design. This WS will be organised in collaboration with Evotec.

Final CATMEC network conference

Final CATMEC showcase and presentations

Workshop 6

Training Activities-Workshop 6: Careers Workshop

Outreach 3

Outreach Activities 3

Workshop 1

Training Activities -Workshop 1: Science Communication Course: Communicating Science to Non-Scientists.

Outreach 2

Outreach Activities 2

Outreach 1

Outreach Activities 1

Workshop 3

Training Activities -Workshop 3: Mini MBA: Introduction to business, financial accounting, marketing and strategy.

Workshop 4

Training Activities-Workshop 4: Innovation and Enterprise

Award of PhD degrees

Dissemination & Exploitation

Dissemination & Exploitation Publication of research. Portfolio of publications/patents describing methods for the synthesis and functionalisation of (hetero)aromatic compounds and methods for the stereoselective synthesis of functionalised ketones. Poster and oral presentations by fellows at conferences.

Summer School 1

Training Activities - Summer School 1: A Corbella: A workshop describing recent advances in organic chemistry. Poster presentations by ESRs at summer school.

Documents, reports (1)

Best practice recommendations

Best practice recommendation for PhD examination

Websites, patent fillings, videos etc. (1)

Website

Website completion

Publications

Peer reviewed articles (12)

A Pd-Catalyzed [4 + 2] Annulation Approach to Fluorinated N-Heterocycles

Author(s): Víctor García-Vázquez, Larry Hoteite, Christopher P. Lakeland, David W. Watson, Joseph P. A. Harrity
Published in: Organic Letters, 23/7, 2021, Page(s) 2811-2815, ISSN 1523-7060
Publisher: American Chemical Society
DOI: 10.1021/acs.orglett.1c00752

Pyrimidin‐6‐yl Trifluoroborate Salts as Versatile Templates for Heterocycle Synthesis

Author(s): Joseph P.A. Harrity, David L. Cousins, Prisca Fricero, Kenji P. M. Kopf, Elliot J. McColl, Werngard Czechtizky, Yee Hwee Lim
Published in: Angewandte Chemie International Edition, 2021, ISSN 1433-7851
Publisher: John Wiley & Sons Ltd.
DOI: 10.1002/anie.202101297

Brønsted Base Catalyzed One‐Pot Synthesis of Stereodefined Six‐Member Carbocycles Featuring Transient Trienolates and a Key Intramolecular 1,6‐Addition

Author(s): Olatz Olaizola, Igor Iriarte, Giovanna Zanella, Enrique Gómez‐Bengoa, Iñaki Ganboa, Mikel Oiarbide, Claudio Palomo
Published in: Angewandte Chemie International Edition, 58/40, 2019, Page(s) 14250-14254, ISSN 1433-7851
Publisher: John Wiley & Sons Ltd.
DOI: 10.1002/anie.201908693

Manganese‐Catalyzed Multicomponent Synthesis of Tetrasubstituted Propargylamines: System Development and Theoretical Study

Author(s): Stavros P. Neofotistos, Nikolaos V. Tzouras, Martin Pauze, Enrique Gómez‐Bengoa, Georgios C. Vougioukalakis
Published in: Advanced Synthesis & Catalysis, 2020, ISSN 1615-4150
Publisher: John Wiley & Sons Ltd.
DOI: 10.1002/adsc.202000566

Unprecedented Multicomponent Organocatalytic Synthesis of Propargylic Esters via CO2 Activation

Author(s): Argyro T. Papastavrou Martin Pauze Prof. Dr. Enrique Gómez‐Bengoa Prof. Dr. Georgios C. Vougioukalakis
Published in: ChemCatChem, 11, 2019, Page(s) 1–9, ISSN 1867-3880
Publisher: Wiley - VCH Verlag GmbH & CO. KGaA
DOI: 10.1002/cctc.201900207

α‐Branched Ketone Dienolates: Base‐Catalyzed Generation and Regio‐ and Enantioselective Addition Reactions

Author(s): Iñaki Urruzuno, Odei Mugica, Giovanna Zanella, Silvia Vera, Enrique Gómez-Bengoa, Mikel Oiarbide, Claudio Palomo
Published in: Chemistry – A European Journal, 2019, ISSN 0947-6539
Publisher: John Wiley & Sons Ltd.
DOI: 10.1002/chem.201901694

Synthesis of Indenes by Tandem Gold(I)-Catalyzed Claisen Rearrangement/Hydroarylation Reaction of Propargyl Vinyl Ethers

Author(s): Antonia Rinaldi, Vittoria Langé, Enrique Gómez-Bengoa, Giovanna Zanella, Dina Scarpi, Ernesto G. Occhiato
Published in: The Journal of Organic Chemistry, 84/10, 2019, Page(s) 6298-6311, ISSN 0022-3263
Publisher: American Chemical Society
DOI: 10.1021/acs.joc.9b00646

An umpolung strategy to react catalytic enols with nucleophiles

Author(s): Amparo Sanz-Marco, Samuel Martinez-Erro, Martin Pauze, Enrique Gómez-Bengoa, Belén Martín-Matute
Published in: Nature Communications, 10/1, 2019, ISSN 2041-1723
Publisher: Nature Publishing Group
DOI: 10.1038/s41467-019-13175-5

Base-Catalyzed [1, n ]-Proton Shifts in Conjugated Polyenyl Alcohols and Ethers

Author(s): Nagaraju Molleti, Samuel Martinez-Erro, Alba Carretero Cerdán, Amparo Sanz-Marco, Enrique Gomez-Bengoa, Belén Martín-Matute
Published in: ACS Catalysis, 9/10, 2019, Page(s) 9134-9139, ISSN 2155-5435
Publisher: American Chemical Society
DOI: 10.1021/acscatal.9b02478

Stereospecific Isomerization of Allylic Halides via Ion Pairs with Induced Noncovalent Chirality

Author(s): Samuel Martinez-Erro, Víctor García-Vázquez, Amparo Sanz-Marco, Belén Martín-Matute
Published in: Organic Letters, 22/11, 2020, Page(s) 4123-4128, ISSN 1523-7060
Publisher: American Chemical Society
DOI: 10.1021/acs.orglett.0c01200

Unraveling the Mechanism of the Ir(III)‐Catalyzed Regiospecific Synthesis of α‐Chlorocarbonyl Compounds from Allylic Alcohols

Author(s): Belén Martín-Matute, Man Li, Amparo Sanz-Marco, Samuel Martinez-Erro, Víctor García-Vázquez, Binh Khanh Mai, Jacob Fernández-Gallardo, Fahmi Himo
Published in: Chemistry – A European Journal, 2020, ISSN 0947-6539
Publisher: John Wiley & Sons Ltd.
DOI: 10.1002/chem.202002845

Pentannulation of N-heterocycles by a tandem gold-catalyzed [3,3]-rearrangement/Nazarov reaction of propargyl ester derivatives: a computational study on the crucial role of the nitrogen atom

Author(s): Giovanna Zanella, Martina Petrović, Dina Scarpi, Ernesto G Occhiato, Enrique Gómez-Bengoa
Published in: Beilstein Journal of Organic Chemistry, 16, 2020, Page(s) 3059-3068, ISSN 1860-5397
Publisher: Beilstein-Institut
DOI: 10.3762/bjoc.16.255