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Your search keyword '"de la Rosa, Silvia"' showing total 3 results
Start Over Author "de la Rosa, Silvia" Journal chemical communications
3 results on '"de la Rosa, Silvia"'

2. H2 oxidation versus organic substrate oxidation in non-heme iron mediated reactions with H2O2.

Author

Hassanpour, Azin, Acuña-Parés, Ferran, Luis, Josep M., Cusso, Olaf, Morales de la Rosa, Silvia, Campos-Martín, José Miguel, Fierro, Jose L. G., Costas, Miquel, Lloret-Fillol, Julio, and Mas-Ballesté, Rubén

Subjects
HYDROGEN peroxide, HYDROGEN oxidation, IRON oxidation, HEME, COMPUTATIONAL chemistry
Abstract

Herein we show that species generated upon reaction of α-[Fe(CF3SO3)2(BPMCN)] (BPMCN = N,N′-bis(2-pyridylmethyl)-trans-1,2-diaminocyclohexane) with H2O2 (putatively [FeV(O)(OH)(BPMCN)]) is able to efficiently oxidize H2 to H2O even in the presence of organic substrates, while species formed in the presence of acetic acid (putatively [FeV(O)(OAc)(BPMCN)]) prefer organic substrate oxidation over H2 activation. Mechanistic implications have been analysed with the aid of computational methods. [ABSTRACT FROM AUTHOR]

Published
2015
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3. H2 oxidation versus organic substrate oxidation in non-heme iron mediated reactions with H2O2.

Author

Hassanpour, Azin, Acuña-Parés, Ferran, Luis, Josep M., Cusso, Olaf, Morales de la Rosa, Silvia, Campos-Martín, José Miguel, Fierro, Jose L. G., Costas, Miquel, Lloret-Fillol, Julio, and Mas-Ballesté, Rubén

Subjects
*HYDROGEN peroxide, *HYDROGEN oxidation, *IRON oxidation, *HEME, *COMPUTATIONAL chemistry
Abstract

Herein we show that species generated upon reaction of α-[Fe(CF3SO3)2(BPMCN)] (BPMCN = N,N′-bis(2-pyridylmethyl)-trans-1,2-diaminocyclohexane) with H2O2 (putatively [FeV(O)(OH)(BPMCN)]) is able to efficiently oxidize H2 to H2O even in the presence of organic substrates, while species formed in the presence of acetic acid (putatively [FeV(O)(OAc)(BPMCN)]) prefer organic substrate oxidation over H2 activation. Mechanistic implications have been analysed with the aid of computational methods. [ABSTRACT FROM AUTHOR]

Published
2015
Full Text
View/download PDF

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