Proton or Metal? The H/D Exchange of Arenes in Acidic Solvents

Munz, Dominik; Webster-Gardiner, Michael S.; Fu, Ross; Strassner, Thomas; Goddard, William A; Gunnoe, T Brent

doi:10.1021/cs501620f

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Proton or Metal? The H/D Exchange of Arenes in Acidic Solvents

Author(s): Dominik Munz ¹ , Michael Webster-Gardiner ¹ , Ross Fu ² , Thomas Strassner ³ , William A. Goddard ² , T. Brent Gunnoe ¹

Publication date (Electronic): December 30 2014

Journal: ACS Catalysis

Publisher: American Chemical Society (ACS)

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Most cited references 88

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Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density

Chengteh Lee, Weitao Yang, Robert Parr (1988)

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Density-functional thermochemistry. III. The role of exact exchange

Axel D. Becke (1993)

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The M06 suite of density functionals for main group thermochemistry, thermochemical kinetics, noncovalent interactions, excited states, and transition elements: two new functionals and systematic testing of four M06-class functionals and 12 other functionals

Yan Zhao, Donald G. Truhlar (2008)

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Author and article information

Journal

Title: ACS Catalysis

Abbreviated Title: ACS Catal.

Publisher: American Chemical Society (ACS)

ISSN (Print): 2155-5435

ISSN (Electronic): 2155-5435

Publication date Created: February 06 2015

Publication date (Electronic): December 30 2014

Publication date (Print): February 06 2015

Volume: 5

Issue: 2

Pages: 769-775

Affiliations

[1 ]Department of Chemistry, University of Virginia, Charlottesville, Virginia 22904, United States

[2 ]Materials and Process Simulation Center, California Institute of Technology, Pasadena, California 91125, United States

[3 ]Physikalische Organische Chemie, Technische Universität Dresden, 01069 Dresden, Germany

Article

DOI: 10.1021/cs501620f

SO-VID: 6c05e652-7f8c-460f-921f-aa819e3bbc05

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