Publication | Closed Access
A molecular mechanics approach to mapping the conformational space of diaryl and triarylphosphines
22
Citations
33
References
2006
Year
Molecular SolidLinear Chain CompoundBiochemistryNatural SciencesConformational SpaceChemical BondConformational StudyMathematical ChemistryComputational ChemistryConformer Interconversion BarriersChemistryMolecular MechanicTriaryl PhosphinesBiophysicsMolecular Mechanics Approach
A molecular mechanics force field has been developed which accurately reproduces experimental solid state structures and conformer interconversion barriers for a series of sterically congested diaryl and triaryl phosphines and some of their chalcogenide and Cr(CO)5 derivatives.
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