Probing Stereoselectivity in Ring-Opening Metathesis Polymerization Mediated by Cyclometalated Ruthenium-Based Catalysts: A Combined Experimental and Computational Study
Тип публикации: Journal Article
Дата публикации: 2016-01-13
scimago Q1
wos Q1
БС1
SJR: 5.489
CiteScore: 24.4
Impact factor: 15.6
ISSN: 00027863, 15205126
PubMed ID:
26726835
General Chemistry
Catalysis
Biochemistry
Colloid and Surface Chemistry
Краткое описание
The microstructures of polymers produced by ring-opening metathesis polymerization (ROMP) with cyclometalated Ru-carbene metathesis catalysts were investigated. A strong bias for a cis,syndiotactic microstructure with minimal head-to-tail bias was observed. In instances where trans errors were introduced, it was determined that these regions were also syndiotactic. Furthermore, hypothetical reaction intermediates and transition structures were analyzed computationally. Combined experimental and computational data support a reaction mechanism in which cis,syndio-selectivity is a result of stereogenic metal control, while microstructural errors are predominantly due to alkylidene isomerization via rotation about the Ru═C double bond.
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Rosebrugh L. E. et al. Probing Stereoselectivity in Ring-Opening Metathesis Polymerization Mediated by Cyclometalated Ruthenium-Based Catalysts: A Combined Experimental and Computational Study // Journal of the American Chemical Society. 2016. Vol. 138. No. 4. pp. 1394-1405.
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Rosebrugh L. E., Ahmed T. S., Marx V. M., Hartung J., Liu P., López J. G., Houk K. N., Grubbs R. K. Probing Stereoselectivity in Ring-Opening Metathesis Polymerization Mediated by Cyclometalated Ruthenium-Based Catalysts: A Combined Experimental and Computational Study // Journal of the American Chemical Society. 2016. Vol. 138. No. 4. pp. 1394-1405.
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TY - JOUR
DO - 10.1021/jacs.5b12277
UR - https://doi.org/10.1021/jacs.5b12277
TI - Probing Stereoselectivity in Ring-Opening Metathesis Polymerization Mediated by Cyclometalated Ruthenium-Based Catalysts: A Combined Experimental and Computational Study
T2 - Journal of the American Chemical Society
AU - Rosebrugh, L E
AU - Ahmed, T S
AU - Marx, V M
AU - Hartung, John
AU - Liu, Peng
AU - López, J. G.
AU - Houk, K. N.
AU - Grubbs, Robert K.
PY - 2016
DA - 2016/01/13
PB - American Chemical Society (ACS)
SP - 1394-1405
IS - 4
VL - 138
PMID - 26726835
SN - 0002-7863
SN - 1520-5126
ER -
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@article{2016_Rosebrugh,
author = {L E Rosebrugh and T S Ahmed and V M Marx and John Hartung and Peng Liu and J. G. López and K. N. Houk and Robert K. Grubbs},
title = {Probing Stereoselectivity in Ring-Opening Metathesis Polymerization Mediated by Cyclometalated Ruthenium-Based Catalysts: A Combined Experimental and Computational Study},
journal = {Journal of the American Chemical Society},
year = {2016},
volume = {138},
publisher = {American Chemical Society (ACS)},
month = {jan},
url = {https://doi.org/10.1021/jacs.5b12277},
number = {4},
pages = {1394--1405},
doi = {10.1021/jacs.5b12277}
}
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MLA
Скопировать
Rosebrugh, L. E., et al. “Probing Stereoselectivity in Ring-Opening Metathesis Polymerization Mediated by Cyclometalated Ruthenium-Based Catalysts: A Combined Experimental and Computational Study.” Journal of the American Chemical Society, vol. 138, no. 4, Jan. 2016, pp. 1394-1405. https://doi.org/10.1021/jacs.5b12277.