Quantum chemical study of the Fe(III)-desferrioxamine B siderophore complex—Electronic structure, vibrational frequencies, and equilibrium Fe-isotope fractionation

Author:

Domagal-Goldman S.D.,Paul K.W.,Sparks D.L.,Kubicki J.D.

Publisher

Elsevier BV

Subject

Geochemistry and Petrology

Reference47 articles.

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2. Coordination chemistry of siderophores: thermodynamics and kinetics of iron chelation and release;Albrecht-Gary,1998

3. Theoretical investigation of iron isotope fractionation between Fe (H2O)63+ and Fe(H2O)62+: implications for iron stable isotope geochemistry;Anbar;Geochim. Cosmochim. Acta,2005

4. Hydroxamatkomplexe. 3. Eisen(III)-austausch zwischen sideraminen und komplexonen—diskussion der bildungskonstanten der hydroxamatkomplexe;Anderegg;Helvet. Chim. Acta,1963

5. Density-functional thermochemistry. 5. Systematic optimization of exchange-correlation functionals;Becke;J. Chem. Phys.,1997

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