Free energy calculation of the effects of the fluorinated phosphorus ligands on the C-H and C-C reductive elimination from Pt(IV).
{To gain insight into how fluorination of ligands alters the C-H and C-C reductive elimination from Pt(IV) octahedral complexes, metadynamics and static DFT calcns. have been performed. The C-H and C-C reductive elimination from Pt(IV) octahedral complexes L2Pt(CH3)3X (X = H or CH3, L2 diphosphine ligand
Références
- Titre
- Free energy calculation of the effects of the fluorinated phosphorus ligands on the C-H and C-C reductive elimination from Pt(IV).
- Type de publication
- Article de revue
- Année de publication
- 2008
- Auteurs
- Michel, Carine, and Milet Anne
- Revue
- J. Mol. Struct. THEOCHEM
- Volume
- 852
- Pagination
- 54–61
- ISSN
- 0166-1280
Soumis le 12 avril 2018