A Counterion-Directed Approach to the Diels-Alder Paradigm: Cascade Synthesis of Tricyclic Fused Cyclopropanes

Description

An approach to the intramolecular Diels–Alder reaction has led to a cascade synthesis of complex carbocycles composed of three fused rings and up to five stereocenters with complete stereocontrol. Computational analysis reveals that the reaction proceeds by a Michael/Michael/cyclopropanation/epimerization cascade in which size and coordination of the counterion is key. This date set contains DFT optimised structures as described in the title paper. 

Resources

Name Format Description Link
0 http://data.europa.eu/88u/dataset/oai-zenodo-org-60147
0 http://data.europa.eu/88u/dataset/oai-zenodo-org-60147
0 http://data.europa.eu/88u/dataset/oai-zenodo-org-60147
0 http://data.europa.eu/88u/dataset/oai-zenodo-org-60147
0 http://data.europa.eu/88u/dataset/oai-zenodo-org-60147
0 http://data.europa.eu/88u/dataset/oai-zenodo-org-60147

Tags

  • dft
  • stereoselectivity
  • cyclopropanes
  • computational-chemistry
  • diels-alder

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