Literature DB >> 15962953

Structural and kinetic studies on uranyl(V) carbonate complex using 13C NMR spectroscopy.

Koichiro Mizuoka1, Ingmar Grenthe, Yasuhisa Ikeda.   

Abstract

We have measured 13C NMR spectra of uranyl(V) carbonate complex in D2O solution containing 1.003 M Na2(13)CO3 at various temperatures. Two singlet signals corresponding to free and coordinated CO3(2-) were observed at 169.13 and 106.70 ppm, respectively. From the peak area ratio, the structure of the uranyl(V) carbonate complex was determined as [U(V)O2(CO3)3]5-. Furthermore, kinetic analyses of the exchange reaction of free and coordinated CO3(2-) in [U(V)O2(CO3)3]5- were carried out using 13C NMR line-broadening. As a result, the first-order rate constant at 298 K and the activation parameters for CO3(2-) exchange reaction in [U(V)O2(CO3)3]5- were evaluated as 1.13 x 10(3) s(-1) and deltaH(double dagger) = 62.0 +/- 0.7 kJ x mol(-1), deltaS(double dagger) = 22 +/- 3 J x mol(-1) x K(-1), respectively. We suggest that the exchange follows a dissociative mechanism as in the corresponding [U(VI)O2(CO3)3]4- complex.

Entities:  

Year:  2005        PMID: 15962953     DOI: 10.1021/ic050308x

Source DB:  PubMed          Journal:  Inorg Chem        ISSN: 0020-1669            Impact factor:   5.165


  2 in total

1.  Visualizing different uranium oxidation states during the surface alteration of uraninite and uranium tetrachloride.

Authors:  Kay Grossmann; Thuro Arnold; Robin Steudtner; Stefan Weiss; Gert Bernhard
Journal:  Naturwissenschaften       Date:  2009-06-06

2.  Quantum mechanical calculation of aqueuous uranium complexes: carbonate, phosphate, organic and biomolecular species.

Authors:  James D Kubicki; Gary P Halada; Prashant Jha; Brian L Phillips
Journal:  Chem Cent J       Date:  2009-08-18       Impact factor: 4.215

  2 in total

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