Metal-ligand complexes molecular orbitals

The loss of degeneracy of atomic or molecular levels in a molecular entity with a given symmetry by the attachment or removal of ligands to produce reduced symmetries. Ligand field theory treats metal ligand complexation as a consequence of molecular orbital formation, whereas crystal field splitting considers ligands as point... 

In summary, all bis(dithiolene) complexes are redox active most of them undergo two or three reversible, one-electron redox reactions. The dithiolene ligand itself is also redox active, which contributes significantly to the redox properties of the metal complex. Molecular orbital pictures derived from quantum mechanical calculations are consistent with the observed redox potential data. 

The application of organometallic compounds in medicine, pharmacy, agriculture and industry requires the accurate determination of these metals as part of their application. Most % complexes characterised by direct carbon-to-carbon metal bonding may be classified as organometallic and the nature and characteristics of the n ligands are similar to those in the coordination metal-ligand complexes. The -complex metals are the least satisfactorily described by crystal field theory (CFT) or valence bond theory (VBT). They are better treated by molecular orbital theory (MOT) and ligand field theory (LFT). There are several uses of metal 7i-complexes and metal catalysed reactions that proceed via substrate metal rc-complex intermediate. Examples of these are the polymerisation of ethylene and the hydration of olefins to form aldehydes as in the Wacker process of air oxidation of ethylene to produce acetaldehyde. 

There are two major theories of bonding in d-metal complexes. Crystal field theory was first devised to explain the colors of solids, particularly ruby, which owes its color to Cr3+ ions, and then adapted to individual complexes. Crystal field theory is simple to apply and enables us to make useful predictions with very little labor. However, it does not account for all the properties of complexes. A more sophisticated approach, ligand field theory (Section 16.12), is based on molecular orbital theory. 

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