Bond models for the photochemical reactivity of transition metal complexes
โ Scribed by Claudio Furlani
- Publisher
- Springer
- Year
- 1974
- Tongue
- English
- Weight
- 273 KB
- Volume
- 34
- Category
- Article
- ISSN
- 1432-2234
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๐ SIMILAR VOLUMES
The metal-ligand bond dissociation energies (CO)nM-L are theoretically predicted at the HF, MP2 and CCSD(T) levels of theory using effective core potentials for the metals for M ---Cr, Mo, W, Ni, Pd, Pt and for L = CO, NO +, CN-, NC-, CS, SiO, N 2. The bond energies at the HF level are too low and t
The theoretical modelling of chemically active transition metal (TM) centres is a notoriously difficult task. The metal-ligand interactions in these complexes are often highly directional and the concoction of suitable analytic interaction potentials can be far from trivial. The situation is rendere
The bond-dissociation energies (BDEs) of more than twenty areneฯชM + complexes (M = Cr, Fe, Co) have been studied by mass spectrometry, using the kinetic method. With minor exceptions, the same relative order of BDEs is found for the three metals and the series of substituted arenes: electrondonating
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