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1 article(s) from Breugst, Martin

Cobalt-catalyzed C–H cyanations: Insights into the reaction mechanism and the role of London dispersion

Eric Detmar,
Valentin Müller,
Daniel Zell,
Lutz Ackermann and
Martin Breugst

Beilstein J. Org. Chem. 2018, 14, 1537–1545, doi:10.3762/bjoc.14.130

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Scheme 1: Cycloaddition reaction of in situ generated benzynes resulting in the sterically more hindered addu...

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Scheme 2: Recently developed cobalt-catalyzed C–H cyanation [30].

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Figure 1: Calculated free-energy profile for the cobalt-catalyzed C–H cyanation of 2-phenylpyridine (1a) [in ...

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Figure 2: Calculated structures, selected bond lengths (in Å), and imaginary frequencies for representative i...

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Scheme 3: Kinetic profile of the cobalt-catalyzed C–H cyanation with differently substituted cyanating agents ...

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Figure 3: Noncovalent interaction (NCI) analysis for selected intermediates and transition states. The gradie...

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Figure 4: Projected dispersion interaction density (DID) plots for selected intermediates and transition stat...

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Published 25 Jun 2018

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