Palladium(0) alkyne complexes as active species: a DFT investigation
2005 (English)In: Chemical Communications, ISSN 1359-7345, E-ISSN 1364-548X, no 33, 4196-4198 p.Article in journal (Refereed) Published
Alkynes have been found to be excellent ligands for Pd(0); the stability of a range of alkyne-Pd(0) complexes, and their reactivity in oxidative addition, have been investigated by DFT methods.
Place, publisher, year, edition, pages
2005. no 33, 4196-4198 p.
DENSITY-FUNCTIONAL CALCULATIONS, OXIDATIVE ADDITION, DISUBSTITUTED ACETYLENES, ARYL HALIDES, HYDROVINYLATION, SOLVATION, NITROGEN
IdentifiersURN: urn:nbn:se:kth:diva-48886DOI: 10.1039/b507784bISI: 000231246300018OAI: oai:DiVA.org:kth-48886DiVA: diva2:488398
QC 201202022012-02-012011-11-232012-02-02Bibliographically approved