Ontology highlight
ABSTRACT:
SUBMITTER: Niemeyer ZL
PROVIDER: S-EPMC5903265 | biostudies-literature | 2017 Sep
REPOSITORIES: biostudies-literature
Niemeyer Zachary L ZL Pindi Suresh S Khrakovsky Dimitri A DA Kuzniewski Christian N CN Hong Cynthia M CM Joyce Leo A LA Sigman Matthew S MS Toste F Dean FD
Journal of the American Chemical Society 20170908 37
Computed descriptors for acyclic diaminocarbene ligands are developed in the context of a gold catalyzed enantioselective tandem [3,3]-sigmatropic rearrangement-[2+2]-cyclization. Surrogate structures enable the rapid identification of parameters that reveal mechanistic characteristics. The observed selectivity trends are validated in a robust multivariate analysis facilitating the development of a highly enantioselective process. ...[more]