Polyhydrides of platinum group metals: Nonclassical interactions and σ-bond activation reactions

MA Esteruelas, AM Lopez, M Olivan - Chemical Reviews, 2016 - ACS Publications
The preparation, structure, dynamic behavior in solution, and reactivity of polyhydride
complexes of platinum group metals, described during the last three decades, are …

Density functional theory methods applied to homogeneous and heterogeneous catalysis: a short review and a practical user guide

V Butera - Physical Chemistry Chemical Physics, 2024 - pubs.rsc.org
The application of density functional theory (DFT) methods in catalysis has been fast
growing in the last decades thanks to both the availability of more powerful high computing …

Mechanistic Studies of the Dehydrocoupling and Dehydropolymerization of Amine–Boranes Using a [Rh(Xantphos)]+ Catalyst

HC Johnson, EM Leitao, GR Whittell… - Journal of the …, 2014 - ACS Publications
A detailed catalytic, stoichiometric, and mechanistic study on the dehydrocoupling of H3B·
NMe2H and dehydropolymerization of H3B· NMeH2 using the [Rh (Xantphos)]+ fragment is …

Combining protons and hydrides by homogeneous catalysis for controlling the release of hydrogen from ammonia–borane: Present status and challenges

S Bhunya, T Malakar, G Ganguly, A Paul - ACS Catalysis, 2016 - ACS Publications
Ammonia–borane (AB) has been in the spotlight for its much touted potential as an onboard
vehicular hydrogen delivery material. Over the past decade, catalyzed dehydrogenation …

Iron-catalyzed dehydrocoupling/dehydrogenation of amine–boranes

JR Vance, A Schäfer, APM Robertson… - Journal of the …, 2014 - ACS Publications
The readily available iron carbonyl complexes,[CpFe (CO) 2] 2 (1) and CpFe (CO) 2I (2)(Cp=
η-C5H5), were found to be efficient precatalysts for the dehydrocoupling/dehydrogenation of …

Development of a generic mechanism for the dehydrocoupling of amine-boranes: a stoichiometric, catalytic, and kinetic study of H3B· NMe2H using the [Rh (PCy3) 2]+ …

LJ Sewell, GC Lloyd-Jones… - Journal of the American …, 2012 - ACS Publications
The multistage Rh-catalyzed dehydrocoupling of the secondary amine-borane H3B·
NMe2H, to give the cyclic amino-borane [H2BNMe2] 2, has been explored using catalysts …

Multiple metal-bound oligomers from Ir-catalysed dehydropolymerisation of H 3 B· NH 3 as probed by experiment and computation

A Kumar, HC Johnson, TN Hooper, AS Weller… - Chemical …, 2014 - pubs.rsc.org
Multiple metal-bound oligomers in the dehydropolymerisation of H3B· NH3 have been
observed by electrospray-ionisation mass spectrometry and NMR spectroscopy using the …

On-Demand Metal-to-Metal Electron Donation during Zr–Ru Heterodinuclear-Catalyzed Amine–Borane Dehydrogenation

J Kumawat, DH Ess - ACS Catalysis, 2024 - ACS Publications
Dinuclear metal–metal cooperative effects are important in catalysis involving the activation
of small molecules with strong bonds. Here, we report density functional theory calculations …

The curious saga of dehydrogenation/hydrogenation for chemical hydrogen storage: a mechanistic perspective

I Bhattacharjee, M Sultana, S Bhunya… - Chemical …, 2022 - pubs.rsc.org
Hydrogen storage is an indispensable component of hydrogen-based fuel economy.
Chemical hydrogen storage relies on the development of lightweight compounds which can …

Dehydrogenation of Diamine–Monoboranes to Cyclic Diaminoboranes: Efficient Ruthenium‐Catalyzed Dehydrogenative Cyclization

CJ Wallis, H Dyer, L Vendier, G Alcaraz… - Angewandte Chemie …, 2012 - infona.pl
Remote control: The title reaction is the first example of a catalyzed dehydrogenative
cyclization (CDC) of diamine–monoboranes to give cyclic diaminoboranes. The cyclization …