Thioether-ligated iron(ii) and iron(iii)-hydroperoxo/alkylperoxo complexes with an H-bond donor in the second coordination sphere

Leland R. Widger; Yunbo Jiang; Alison C. McQuilken; Tzuhsiung Yang; Maxime A. Siegler; Hirotoshi Matsumura; Pierre Moënne-Loccoz; Devesh Kumar; Sam P. De Visser; David P. Goldberg

doi:10.1039/c4dt00281d

Thioether-ligated iron(ii) and iron(iii)-hydroperoxo/alkylperoxo complexes with an H-bond donor in the second coordination sphere

Leland R. Widger, Yunbo Jiang, Alison C. McQuilken, Tzuhsiung Yang, Maxime A. Siegler, Hirotoshi Matsumura, Pierre Moënne-Loccoz, Devesh Kumar, Sam P. De Visser, David P. Goldberg

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Abstract

The non-heme iron complexes, [FeII(N3PySR)(CH 3CN)](BF4)2 (1) and [FeII(N3Py amideSR)](BF4)2 (2), afford rare examples of metastable Fe(iii)-OOH and Fe(iii)-OOtBu complexes containing equatorial thioether ligands and a single H-bond donor in the second coordination sphere. These peroxo complexes were characterized by a range of spectroscopic methods and density functional theory studies. The influence of a thioether ligand and of one H-bond donor on the stability and spectroscopic properties of these complexes was investigated. This journal is © the Partner Organisations 2014.

Original language	English
Pages (from-to)	7522-7532
Number of pages	10
Journal	Dalton Transactions
Volume	43
Issue number	20
DOIs	https://doi.org/10.1039/c4dt00281d
Publication status	Published - 28 May 2014

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CCDC 976173: Experimental Crystal Structure Determination
Widger, L. R. (Contributor), Jiang, Y. (Contributor), McQuilken, A. C. (Contributor), Yang, T. (Contributor), Siegler, M. A. (Contributor), Matsumura, H. (Contributor), Moënne-Loccoz, P. (Contributor), Kumar, D. (Contributor), De Visser, S. (Contributor) & Goldberg, D. P. (Contributor), Cambridge Crystallographic Data Centre, 2013
DOI: 10.5517/cc11rsg1, http://www.ccdc.cam.ac.uk/services/structure_request?id=doi:10.5517/cc11rsg1&sid=DataCite
Dataset
CCDC 976172: Experimental Crystal Structure Determination
Widger, L. R. (Contributor), Jiang, Y. (Contributor), McQuilken, A. C. (Contributor), Yang, T. (Contributor), Siegler, M. A. (Contributor), Matsumura, H. (Contributor), Moënne-Loccoz, P. (Contributor), Kumar, D. (Contributor), De Visser, S. (Contributor) & Goldberg, D. P. (Contributor), Cambridge Crystallographic Data Centre, 2013
DOI: 10.5517/cc11rsf0, http://www.ccdc.cam.ac.uk/services/structure_request?id=doi:10.5517/cc11rsf0&sid=DataCite
Dataset
CCDC 976174: Experimental Crystal Structure Determination
Widger, L. R. (Contributor), Jiang, Y. (Contributor), McQuilken, A. C. (Contributor), Yang, T. (Contributor), Siegler, M. A. (Contributor), Matsumura, H. (Contributor), Moënne-Loccoz, P. (Contributor), Kumar, D. (Contributor), De Visser, S. (Contributor) & Goldberg, D. P. (Contributor), Cambridge Crystallographic Data Centre, 1 Jan 2013
DOI: 10.5517/cc11rsh2, http://www.ccdc.cam.ac.uk/services/structure_request?id=doi:10.5517/cc11rsh2&sid=DataCite
Dataset

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@article{31ad574c122240eea2a2c1951310421f,

title = "Thioether-ligated iron(ii) and iron(iii)-hydroperoxo/alkylperoxo complexes with an H-bond donor in the second coordination sphere",

abstract = "The non-heme iron complexes, [FeII(N3PySR)(CH 3CN)](BF4)2 (1) and [FeII(N3Py amideSR)](BF4)2 (2), afford rare examples of metastable Fe(iii)-OOH and Fe(iii)-OOtBu complexes containing equatorial thioether ligands and a single H-bond donor in the second coordination sphere. These peroxo complexes were characterized by a range of spectroscopic methods and density functional theory studies. The influence of a thioether ligand and of one H-bond donor on the stability and spectroscopic properties of these complexes was investigated. This journal is {\textcopyright} the Partner Organisations 2014.",

author = "Widger, {Leland R.} and Yunbo Jiang and McQuilken, {Alison C.} and Tzuhsiung Yang and Siegler, {Maxime A.} and Hirotoshi Matsumura and Pierre Mo{\"e}nne-Loccoz and Devesh Kumar and {De Visser}, {Sam P.} and Goldberg, {David P.}",

note = "cited By 0",

year = "2014",

month = may,

day = "28",

doi = "10.1039/c4dt00281d",

language = "English",

volume = "43",

pages = "7522--7532",

journal = "Dalton Transactions",

issn = "1477-9234",

publisher = "Royal Society of Chemistry",

number = "20",

}

TY - JOUR

T1 - Thioether-ligated iron(ii) and iron(iii)-hydroperoxo/alkylperoxo complexes with an H-bond donor in the second coordination sphere

AU - Widger, Leland R.

AU - Jiang, Yunbo

AU - McQuilken, Alison C.

AU - Yang, Tzuhsiung

AU - Siegler, Maxime A.

AU - Matsumura, Hirotoshi

AU - Moënne-Loccoz, Pierre

AU - Kumar, Devesh

AU - De Visser, Sam P.

AU - Goldberg, David P.

N1 - cited By 0

PY - 2014/5/28

Y1 - 2014/5/28

N2 - The non-heme iron complexes, [FeII(N3PySR)(CH 3CN)](BF4)2 (1) and [FeII(N3Py amideSR)](BF4)2 (2), afford rare examples of metastable Fe(iii)-OOH and Fe(iii)-OOtBu complexes containing equatorial thioether ligands and a single H-bond donor in the second coordination sphere. These peroxo complexes were characterized by a range of spectroscopic methods and density functional theory studies. The influence of a thioether ligand and of one H-bond donor on the stability and spectroscopic properties of these complexes was investigated. This journal is © the Partner Organisations 2014.

AB - The non-heme iron complexes, [FeII(N3PySR)(CH 3CN)](BF4)2 (1) and [FeII(N3Py amideSR)](BF4)2 (2), afford rare examples of metastable Fe(iii)-OOH and Fe(iii)-OOtBu complexes containing equatorial thioether ligands and a single H-bond donor in the second coordination sphere. These peroxo complexes were characterized by a range of spectroscopic methods and density functional theory studies. The influence of a thioether ligand and of one H-bond donor on the stability and spectroscopic properties of these complexes was investigated. This journal is © the Partner Organisations 2014.

U2 - 10.1039/c4dt00281d

DO - 10.1039/c4dt00281d

M3 - Article

SN - 1477-9234

VL - 43

SP - 7522

EP - 7532

JO - Dalton Transactions

JF - Dalton Transactions

IS - 20

ER -

Thioether-ligated iron(ii) and iron(iii)-hydroperoxo/alkylperoxo complexes with an H-bond donor in the second coordination sphere

Abstract

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Datasets

CCDC 976173: Experimental Crystal Structure Determination

CCDC 976172: Experimental Crystal Structure Determination

CCDC 976174: Experimental Crystal Structure Determination

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