Bibliographic Details
| Title: |
Beyond holo/hemidirectionality in Pb(II) complexes: Can the valence lone pair be bisdirected? |
| Authors: |
Severen, M.-C. van, Piquemal, J.-P. jpp@lct.jussieu.fr, Parisel, O. parisel@lct.jussieu.fr |
| Source: |
Chemical Physics Letters. Aug2009, Vol. 478 Issue 1-3, p17-19. 3p. |
| Subjects: |
Metal complexes, Lead compounds, Density functionals, Conduction electrons, Localization theory |
| Abstract: |
Abstract: In this contribution, we investigate, by means of Density Functional Theory computations coupled to the analysis of the Electron Localisation Function (ELF), a new possible topology of the Pb2+ valence lone pair. The possibility of bisdirectionality is uncovered for the first time and reveals another character of lead complexes beyond holo/hemidirectionality. [Copyright &y& Elsevier] |
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| Database: |
Engineering Source |
