Expansion of the Ligand Knowledge Base for Chelating P,P-Donor Ligands (LKB-PP).

ABSTRACT: We have expanded the ligand knowledge base for bidentate P,P- and P,N-donor ligands (LKB-PP, Organometallics2008, 31, 1372-1383) by 208 ligands and introduced an additional steric descriptor (nHe₈). This expanded knowledge base now captures information on 334 bidentate ligands and has been processed with principal component analysis (PCA) of the descriptors to produce a detailed map of bidentate ligand space, which better captures ligand variation and has been used for the analysis of ligand properties.

SUBMITTER: Jover J 

PROVIDER: S-EPMC4034078 | biostudies-literature | 2012 Aug

REPOSITORIES: biostudies-literature