Literature DB >> 27274699

The reaction of formic acid with RaneyTM copper.

Samantha K Callear1, Ian P Silverwood2, Arunabhiram Chutia2, C Richard A Catlow3, Stewart F Parker4.   

Abstract

The interaction of formic acid with RaneyTM Cu proves to be complex. Rather than the expected generation of a monolayer of bidentate formate, we find the formation of a Cu(II) compound. This process occurs by direct reaction of copper and formic acid; in contrast, previous methods are by solution reaction. This is a rare example of formic acid acting as an oxidant rather than, as more commonly found, a reductant. The combination of diffraction, spectroscopic and computational methods has allowed this unexpected process to be characterized.

Entities:  

Keywords:  copper; density functional theory; formate; methanol synthesis; neutron scattering

Year:  2016        PMID: 27274699      PMCID: PMC4892286          DOI: 10.1098/rspa.2016.0126

Source DB:  PubMed          Journal:  Proc Math Phys Eng Sci        ISSN: 1364-5021            Impact factor:   2.704


  6 in total

1.  The Cambridge Structural Database: a quarter of a million crystal structures and rising.

Authors:  Frank H Allen
Journal:  Acta Crystallogr B       Date:  2002-05-29

2.  From CO(2) to Methanol by Hybrid QM/MM Embedding This work was supported by EU Esprit IV project 25047. S.A.F. is grateful to ICI and Synetix for funding. K. Waugh, L. Whitmore, S. Cristol, and P. Sushko are thanked for their helpful insights. QM/MM=quantum mechanics/molecular mechanics.

Authors:  Samuel A. French; Alexey A. Sokol; Stefan T. Bromley; C. Richard A. Catlow; Stephen C. Rogers; Frank King; Paul Sherwood
Journal:  Angew Chem Int Ed Engl       Date:  2001-12-03       Impact factor: 15.336

3.  The active site of methanol synthesis over Cu/ZnO/Al2O3 industrial catalysts.

Authors:  Malte Behrens; Felix Studt; Igor Kasatkin; Stefanie Kühl; Michael Hävecker; Frank Abild-Pedersen; Stefan Zander; Frank Girgsdies; Patrick Kurr; Benjamin-Louis Kniep; Michael Tovar; Richard W Fischer; Jens K Nørskov; Robert Schlögl
Journal:  Science       Date:  2012-04-19       Impact factor: 47.728

4.  Structure determination of adsorbed hydrogen on a real catalyst.

Authors:  Stewart F Parker; Daniel T Bowron; Silvia Imberti; Alan K Soper; Keith Refson; Egbert S Lox; Marco Lopez; Peter Albers
Journal:  Chem Commun (Camb)       Date:  2010-03-05       Impact factor: 6.222

5.  Structural, electronic and vibrational properties of tetragonal zirconia under pressure: a density functional theory study.

Authors:  Victor Milman; Alexander Perlov; Keith Refson; Stewart J Clark; Jacob Gavartin; Bjoern Winkler
Journal:  J Phys Condens Matter       Date:  2009-11-06       Impact factor: 2.333

6.  Assisted deprotonation of formic acid on Cu(111) and self-assembly of 1D chains.

Authors:  Ashleigh E Baber; Kumudu Mudiyanselage; Sanjaya D Senanayake; Alba Beatriz-Vidal; Kyle A Luck; E Charles H Sykes; Ping Liu; José A Rodriguez; Darío J Stacchiola
Journal:  Phys Chem Chem Phys       Date:  2013-06-17       Impact factor: 3.676

  6 in total

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