Mechanism-led development of catalytic C-H functionalisation
Lead Research Organisation:
Heriot-Watt University
Department Name: Sch of Engineering and Physical Science
Abstract
Abstracts are not currently available in GtR for all funded research. This is normally because the abstract was not required at the time of proposal submission, but may be because it included sensitive information such as personal details.
Organisations
People |
ORCID iD |
| Stuart Macgregor (Principal Investigator) |
Publications
Algarra AG
(2015)
Combined experimental and computational investigations of rhodium-catalysed C - H functionalisation of pyrazoles with alkenes.
in Chemistry (Weinheim an der Bergstrasse, Germany)
Algarra AG
(2014)
Combined experimental and computational investigations of rhodium- and ruthenium-catalyzed C-H functionalization of pyrazoles with alkynes.
in The Journal of organic chemistry
Alharis RA
(2019)
The Importance of Kinetic and Thermodynamic Control when Assessing Mechanisms of Carboxylate-Assisted C-H Activation.
in Journal of the American Chemical Society
Alharis RA
(2019)
Understanding electronic effects on carboxylate-assisted C-H activation at ruthenium: the importance of kinetic and thermodynamic control.
in Faraday discussions
Carr K
(2016)
C-H Bond Activation and Catalytic Functionalization I
Davies DL
(2015)
Experimental and DFT Studies Explain Solvent Control of C-H Activation and Product Selectivity in the Rh(III)-Catalyzed Formation of Neutral and Cationic Heterocycles.
in Journal of the American Chemical Society
Davies DL
(2017)
Computational Studies of Carboxylate-Assisted C-H Activation and Functionalization at Group 8-10 Transition Metal Centers.
in Chemical reviews
Johnson HC
(2013)
Dehydrogenative boron homocoupling of an amine-borane.
in Angewandte Chemie (International ed. in English)
Miloserdov F
(2014)
The Challenge of Palladium-Catalyzed Aromatic Azidocarbonylation: From Mechanistic and Catalyst Deactivation Studies to a Highly Efficient Process
in Organometallics
Perrin L
(2016)
Computational Studies in Organometallic Chemistry
| Description | Understanding mechanism of C-H activation at transition metal catalysts |
| Exploitation Route | In designing better metal catalysts |
| Sectors | Chemicals |
| Description | For a series of related substrates the selectivity can change dependent on the reaction conditions. Hence, assigning a reaction mechanism to these types of reaction based on a single set of conditions can lead to erroneous conclusions. |
| Sector | Chemicals |