Computational Studies on Phosphorus Chemistry: Structure, Spectroscopy and Mechanisms provides a theoretical overview of the optimized structures, synthesis and transformation pathways in phosphorous chemistry; it also introduces the interaction and reaction mechanisms of phosphorus compounds through multiple kinds of simulations and calculations studies. It includes: theoretical methods and examples; theoretical studies on the optimized structures, stereochemistry, spectroscopy, and reaction mechanism of phosphorus-containing compounds; computational chemistry of the compounds of metal-organophosphorus ligand; the mechanism of organophosphine-catalyzed reactions; computational biotransformation of phosphorus containing drugs; and computational study of phosphorus-containing pesticides, phosphorus containing neurotoxic agents, and phosphorus-containing materials
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