Title of article :
Structure and dynamics of the hydrated palladium(II) ion in aqueous solution A QMCF MD simulation and EXAFS spectroscopic study
Author/Authors :
Hofer، نويسنده , , Thomas S. and Randolf، نويسنده , , Bernhard R. and Adnan Ali Shah، نويسنده , , S. and Rode، نويسنده , , Bernd M. and Persson، نويسنده , , Ingmar، نويسنده ,
Issue Information :
روزنامه با شماره پیاپی سال 2007
Pages :
5
From page :
193
To page :
197
Abstract :
The pharmacologically and industrially important palladium(II) ion is usually characterised as square-planar structure in aqueous solution, similar to the platinum(II) ion. Our investigations by means of the most modern experimental and theoretical methods give clear indications, however, that the hydrated palladium(II) ion is hexa-coordinated, with four ligands arranged in a plane at 2.0 Å plus two additional ligands in axial positions showing an elongated bond distance of 2.7–2.8 Å. The second shell consists in average of 8.0 ligands at a mean distance of 4.4 Å. This structure provides a new basis for the interpretation of the kinetic properties of palladium(II) complexes.
Journal title :
Chemical Physics Letters
Serial Year :
2007
Journal title :
Chemical Physics Letters
Record number :
1922613
Link To Document :
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