The Role of Alkoxide Initiator, Spin State, and Oxidation State in Ring-Opening Polymerization of ε-Caprolactone Catalyzed by Iron Bis(imino)pyridine Complexes
Тип публикации: Journal Article
Дата публикации: 2018-01-30
scimago Q1
wos Q1
white level БС1
SJR: 0.958
CiteScore: 7.4
Impact factor: 4.7
ISSN: 00201669, 1520510X
PubMed ID:
29381341
Inorganic Chemistry
Physical and Theoretical Chemistry
Краткое описание
Density functional theory (DFT) is employed to characterize in detail the mechanism for the ring-opening polymerization (ROP) of ε-caprolactone catalyzed by iron alkoxide complexes bearing redox-active bis(imino)pyridine ligands. The combination of iron with the non-innocent bis(imino)pyridine ligand permits comparison of catalytic activity as a function of oxidation state (and overall spin state). The reactivities of aryl oxide versus alkoxide initiators for the ROP of ε-caprolactone are also examined. An experimental test of a computational prediction reveals an Fe(III) bis(imino)pyridine bis-neopentoxide complex to be competent for ROP of ε-caprolactone.
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Ortuño M. A. et al. The Role of Alkoxide Initiator, Spin State, and Oxidation State in Ring-Opening Polymerization of ε-Caprolactone Catalyzed by Iron Bis(imino)pyridine Complexes // Inorganic Chemistry. 2018. Vol. 57. No. 4. pp. 2064-2071.
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Ortuño M. A., Dereli B., Delle Chiaie K. R., Biernesser A. B., Miao Q., Byers J. A., Cramer C. S. The Role of Alkoxide Initiator, Spin State, and Oxidation State in Ring-Opening Polymerization of ε-Caprolactone Catalyzed by Iron Bis(imino)pyridine Complexes // Inorganic Chemistry. 2018. Vol. 57. No. 4. pp. 2064-2071.
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TY - JOUR
DO - 10.1021/acs.inorgchem.7b02964
UR - https://doi.org/10.1021/acs.inorgchem.7b02964
TI - The Role of Alkoxide Initiator, Spin State, and Oxidation State in Ring-Opening Polymerization of ε-Caprolactone Catalyzed by Iron Bis(imino)pyridine Complexes
T2 - Inorganic Chemistry
AU - Ortuño, Manuel A.
AU - Dereli, Büsra
AU - Delle Chiaie, Kayla R
AU - Biernesser, Ashley B
AU - Miao, Qi
AU - Byers, Jeffery A.
AU - Cramer, Christopher S.
PY - 2018
DA - 2018/01/30
PB - American Chemical Society (ACS)
SP - 2064-2071
IS - 4
VL - 57
PMID - 29381341
SN - 0020-1669
SN - 1520-510X
ER -
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@article{2018_Ortuño,
author = {Manuel A. Ortuño and Büsra Dereli and Kayla R Delle Chiaie and Ashley B Biernesser and Qi Miao and Jeffery A. Byers and Christopher S. Cramer},
title = {The Role of Alkoxide Initiator, Spin State, and Oxidation State in Ring-Opening Polymerization of ε-Caprolactone Catalyzed by Iron Bis(imino)pyridine Complexes},
journal = {Inorganic Chemistry},
year = {2018},
volume = {57},
publisher = {American Chemical Society (ACS)},
month = {jan},
url = {https://doi.org/10.1021/acs.inorgchem.7b02964},
number = {4},
pages = {2064--2071},
doi = {10.1021/acs.inorgchem.7b02964}
}
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MLA
Скопировать
Ortuño, Manuel A., et al. “The Role of Alkoxide Initiator, Spin State, and Oxidation State in Ring-Opening Polymerization of ε-Caprolactone Catalyzed by Iron Bis(imino)pyridine Complexes.” Inorganic Chemistry, vol. 57, no. 4, Jan. 2018, pp. 2064-2071. https://doi.org/10.1021/acs.inorgchem.7b02964.
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