Zobrazeno 1 - 4
of 4
pro vyhledávání: '"Miasser Al-Ghamdi"'
Autor:
Dirk J. Beetstra, Luigi Cavallo, Miasser Al-Ghamdi, Laura Falivene, F. A. Pasha, Sai V. C. Vummaleti
Publikováno v:
Organometallics. 36:1107-1112
Density functional theory calculations have been used to investigate competition between inner- and outer-sphere reaction pathways in the oxidative coupling of CO2 and ethylene for a set of 12 Ni–bisphosphine complexes, in order to build a QSAR app
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::acab51570e4087ab4bbc32585ad796b1
https://doi.org/10.1021/acs.organomet.6b00905
https://doi.org/10.1021/acs.organomet.6b00905
Publikováno v:
The Journal of Physical Chemistry C. 121:2730-2737
We report a mechanistic DFT investigation of the organopolymerization of propylene oxide (PO) promoted by N-heterocyclic olefins (NHOs) in combination with benzylic alcohol (BnOH). Calculations support the experimentally based hypothesis of two compe
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::ca31d185f21ad0124a7a6729566eabce
https://doi.org/10.1021/acs.jpcc.6b10977
https://doi.org/10.1021/acs.jpcc.6b10977
Publikováno v:
Macromolecules. 49:7777-7784
We report on a DFT investigation of initiation, propagation, and termination in the organopolymerization of N-methyl N-carboxyanhydrides toward cyclic poly(N-substituted glycine)s, promoted by N-heterocyclic carbenes (NHC). Calculations support the e
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::d17ef9e0a7f19e7f6e788a3caf76e669
https://doi.org/10.1021/acs.macromol.6b01722
https://doi.org/10.1021/acs.macromol.6b01722
Autor:
Dirk J. Beetstra, Laura Falivene, Sai V. C. Vummaleti, Jessica Scaranto, Albert Poater, Miasser Al-Ghamdi, Jason G. M. Morton, Luigi Cavallo
Publikováno v:
© Organometallics, 2015, vol. 34, núm. 23, p. 5549-5554
Articles publicats (D-Q)
DUGiDocs – Universitat de Girona
instname
Articles publicats (D-Q)
DUGiDocs – Universitat de Girona
instname
Density functional theory calculations have been used to investigate the reaction mechanism for the [Rh]-catalyzed intramolecular alkoxyacylation ([Rh] = [RhI(dppp)+] (dppp, 1,3-bis(diphenylphosphino)propane) and [Pd]/BPh3 dual catalytic system assis
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::ea8d5c31ab65e63f57fffdaf06c973f2
https://doi.org/10.1021/acs.organomet.5b00749
https://doi.org/10.1021/acs.organomet.5b00749