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Issue 6, 2015
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Computational aspects of hydroformylation

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Abstract

The influence of transition metal complexes as catalysts upon the activity and selectivity of hydroformylation reactions has been extensively investigated during the last decades. Nowadays computational chemistry is an indispensable tool for elucidation of reaction mechanisms and for understanding the various aspects which govern the outcome of catalytic reactions. This review attempts to survey the recent literature concerning computational studies on hydroformylation and theoretical coordination chemistry results related to hydroformylation.

Graphical abstract: Computational aspects of hydroformylation

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Publication details

The article was received on 25 Oct 2014, accepted on 04 Dec 2014 and first published on 04 Dec 2014


Article type: Review Article
DOI: 10.1039/C4RA13121E
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Citation: RSC Adv., 2015,5, 4304-4327

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    Computational aspects of hydroformylation

    T. Kégl, RSC Adv., 2015, 5, 4304
    DOI: 10.1039/C4RA13121E

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