Reference of 224311-51-7. Chemistry is an experimental science, and the best way to enjoy it and learn about it is performing experiments.Introducing a new discovery about 224311-51-7, Name is 2-(Di-tert-Butylphosphino)biphenyl
Pure and hybrid quantum mechanical calculations were performed to study the pathway of the isomerization of propargyl derivative to conjugated diene under the catalysis of Au(I) complex derived from the biphenyl-2-ylphosphine with a basic amino group on the pendant phenyl ring. It was previously proposed that a push-pull driving force operates orthogonally during the progress of the reaction. Our study reveals that this push-pull force is syn-periplanar rather than orthogonal. Steric pressure by the phosphine ligand, together with the push-pull interaction favors the transformation of eta2 to eta1 mode of Au complex. These effects are responsible for the increasing acidity of the transferring proton. The bent structure of the product suffers from the reduced steric pressure, thus favors the formation of the conjugated diene.
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Phosphine ligand,
Chiral phosphine ligands in asymmetric synthesis. Molecular structure and absolute configuration of (1,5-cyclooctadiene)-(2S,3S)-2,3-bis(diphenylphosphino)butanerhodium(I) perchlorate tetrahydrofuran solvate