The First Lanthanide Complexes with a Redox-Active Sulfur Diimide Ligand: Synthesis and Characterization of [LnCp*2(RN=)2S], Ln=Sm, Eu, Yb; R=SiMe3

Svetlana V. Klementyeva; Nina P. Gritsan; Marat M. Khusniyarov; Alexander Witt; Alexey A. Dmitriev; Elizaveta A. Suturina; Nathan D.D. Hill; Tracey L. Roemmele; Michael T. Gamer; René T. Boeré; Peter W. Roesky; Andrey V. Zibarev; Sergey N. Konchenko

doi:10.1002/chem.201604340

The First Lanthanide Complexes with a Redox-Active Sulfur Diimide Ligand: Synthesis and Characterization of [LnCp*₂(RN=)₂S], Ln=Sm, Eu, Yb; R=SiMe₃

Svetlana V. Klementyeva, Nina P. Gritsan, Marat M. Khusniyarov, Alexander Witt, Alexey A. Dmitriev, Elizaveta A. Suturina, Nathan D.D. Hill, Tracey L. Roemmele, Michael T. Gamer, René T. Boeré, Peter W. Roesky, Andrey V. Zibarev, Sergey N. Konchenko

Результат исследования: Научные публикации в периодических изданиях › статья › рецензирование

13 Цитирования (Scopus)

Аннотация

The first lanthanide complexes with a redox-active sulfur diimide ligand, [LnCp*₂(Me₃SiN=)₂S] (Ln=Sm, Eu, Yb; Cp*=η⁵-C₅Me₅), are reported. The complexes were synthesized by using [LnCp*₂(THF)₂] and (Me₃SiN=)₂S and have been thoroughly characterized by single-crystal X-ray diffraction, EPR spectroscopy, UV/Vis/NIR electronic absorption spectroscopy and SQUID magnetometry. The results, as interpreted by CASSCF/SOC-RASSI calculations providing a non-perturbative treatment of spin-orbit coupling, indicate that these paramagnetic complexes are best described as Ln³⁺ and [(Me₃SiN=)₂S]⁻ ^. adducts. As such, these complexes contain the first isolated and structurally characterized acyclic [(RN=)₂S]⁻ ^. radical anions.

Язык оригинала	английский
Страницы (с-по)	1278-1290
Число страниц	13
Журнал	Chemistry - A European Journal
Том	23
Номер выпуска	6
DOI	https://doi.org/10.1002/chem.201604340
Состояние	Опубликовано - 26 янв. 2017

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Klementyeva, S. V., Gritsan, N. P., Khusniyarov, M. M., Witt, A., Dmitriev, A. A., Suturina, E. A., Hill, N. D. D., Roemmele, T. L., Gamer, M. T., Boeré, R. T., Roesky, P. W., Zibarev, A. V., & Konchenko, S. N. (2017). The First Lanthanide Complexes with a Redox-Active Sulfur Diimide Ligand: Synthesis and Characterization of [LnCp*₂(RN=)₂S], Ln=Sm, Eu, Yb; R=SiMe₃. Chemistry - A European Journal, 23(6), 1278-1290. https://doi.org/10.1002/chem.201604340

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title = "The First Lanthanide Complexes with a Redox-Active Sulfur Diimide Ligand: Synthesis and Characterization of [LnCp*2(RN=)2S], Ln=Sm, Eu, Yb; R=SiMe3",

abstract = "The first lanthanide complexes with a redox-active sulfur diimide ligand, [LnCp*2(Me3SiN=)2S] (Ln=Sm, Eu, Yb; Cp*=η5-C5Me5), are reported. The complexes were synthesized by using [LnCp*2(THF)2] and (Me3SiN=)2S and have been thoroughly characterized by single-crystal X-ray diffraction, EPR spectroscopy, UV/Vis/NIR electronic absorption spectroscopy and SQUID magnetometry. The results, as interpreted by CASSCF/SOC-RASSI calculations providing a non-perturbative treatment of spin-orbit coupling, indicate that these paramagnetic complexes are best described as Ln3+ and [(Me3SiN=)2S]− . adducts. As such, these complexes contain the first isolated and structurally characterized acyclic [(RN=)2S]− . radical anions.",

keywords = "lanthanides, magnetism, quantum chemical calculations, radicals, sulfur diimide, COORDINATION CHEMISTRY, DECAMETHYLYTTERBOCENE COMPLEXES, Z,Z CONFIGURATION, CRYSTAL-STRUCTURE, STRUCTURAL-CHARACTERIZATION, SINGLE-MOLECULE MAGNETS, TRANSITION-METAL, INTERMEDIATE-VALENCE, HETEROCYCLIC RADICAL-ANION, EXCHANGE INTERACTION",

author = "Klementyeva, {Svetlana V.} and Gritsan, {Nina P.} and Khusniyarov, {Marat M.} and Alexander Witt and Dmitriev, {Alexey A.} and Suturina, {Elizaveta A.} and Hill, {Nathan D.D.} and Roemmele, {Tracey L.} and Gamer, {Michael T.} and Boer{\'e}, {Ren{\'e} T.} and Roesky, {Peter W.} and Zibarev, {Andrey V.} and Konchenko, {Sergey N.}",

note = "{\textcopyright} 2017 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim.",

year = "2017",

month = jan,

day = "26",

doi = "10.1002/chem.201604340",

language = "English",

volume = "23",

pages = "1278--1290",

journal = "Chemistry - A European Journal",

issn = "0947-6539",

publisher = "Wiley-VCH Verlag",

number = "6",

}

Klementyeva, SV, Gritsan, NP, Khusniyarov, MM, Witt, A, Dmitriev, AA, Suturina, EA, Hill, NDD, Roemmele, TL, Gamer, MT, Boeré, RT, Roesky, PW, Zibarev, AV & Konchenko, SN 2017, 'The First Lanthanide Complexes with a Redox-Active Sulfur Diimide Ligand: Synthesis and Characterization of [LnCp*₂(RN=)₂S], Ln=Sm, Eu, Yb; R=SiMe₃', Chemistry - A European Journal, том. 23, № 6, стр. 1278-1290. https://doi.org/10.1002/chem.201604340

The First Lanthanide Complexes with a Redox-Active Sulfur Diimide Ligand : Synthesis and Characterization of [LnCp*₂(RN=)₂S], Ln=Sm, Eu, Yb; R=SiMe₃. / Klementyeva, Svetlana V.; Gritsan, Nina P.; Khusniyarov, Marat M. и др.

В: Chemistry - A European Journal, Том 23, № 6, 26.01.2017, стр. 1278-1290.

Результат исследования: Научные публикации в периодических изданиях › статья › рецензирование

TY - JOUR

T1 - The First Lanthanide Complexes with a Redox-Active Sulfur Diimide Ligand

T2 - Synthesis and Characterization of [LnCp*2(RN=)2S], Ln=Sm, Eu, Yb; R=SiMe3

AU - Klementyeva, Svetlana V.

AU - Gritsan, Nina P.

AU - Khusniyarov, Marat M.

AU - Witt, Alexander

AU - Dmitriev, Alexey A.

AU - Suturina, Elizaveta A.

AU - Hill, Nathan D.D.

AU - Roemmele, Tracey L.

AU - Gamer, Michael T.

AU - Boeré, René T.

AU - Roesky, Peter W.

AU - Zibarev, Andrey V.

AU - Konchenko, Sergey N.

PY - 2017/1/26

Y1 - 2017/1/26

N2 - The first lanthanide complexes with a redox-active sulfur diimide ligand, [LnCp*2(Me3SiN=)2S] (Ln=Sm, Eu, Yb; Cp*=η5-C5Me5), are reported. The complexes were synthesized by using [LnCp*2(THF)2] and (Me3SiN=)2S and have been thoroughly characterized by single-crystal X-ray diffraction, EPR spectroscopy, UV/Vis/NIR electronic absorption spectroscopy and SQUID magnetometry. The results, as interpreted by CASSCF/SOC-RASSI calculations providing a non-perturbative treatment of spin-orbit coupling, indicate that these paramagnetic complexes are best described as Ln3+ and [(Me3SiN=)2S]− . adducts. As such, these complexes contain the first isolated and structurally characterized acyclic [(RN=)2S]− . radical anions.

AB - The first lanthanide complexes with a redox-active sulfur diimide ligand, [LnCp*2(Me3SiN=)2S] (Ln=Sm, Eu, Yb; Cp*=η5-C5Me5), are reported. The complexes were synthesized by using [LnCp*2(THF)2] and (Me3SiN=)2S and have been thoroughly characterized by single-crystal X-ray diffraction, EPR spectroscopy, UV/Vis/NIR electronic absorption spectroscopy and SQUID magnetometry. The results, as interpreted by CASSCF/SOC-RASSI calculations providing a non-perturbative treatment of spin-orbit coupling, indicate that these paramagnetic complexes are best described as Ln3+ and [(Me3SiN=)2S]− . adducts. As such, these complexes contain the first isolated and structurally characterized acyclic [(RN=)2S]− . radical anions.

KW - lanthanides

KW - magnetism

KW - quantum chemical calculations

KW - radicals

KW - sulfur diimide

KW - COORDINATION CHEMISTRY

KW - DECAMETHYLYTTERBOCENE COMPLEXES

KW - Z,Z CONFIGURATION

KW - CRYSTAL-STRUCTURE

KW - STRUCTURAL-CHARACTERIZATION

KW - SINGLE-MOLECULE MAGNETS

KW - TRANSITION-METAL

KW - INTERMEDIATE-VALENCE

KW - HETEROCYCLIC RADICAL-ANION

KW - EXCHANGE INTERACTION

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U2 - 10.1002/chem.201604340

DO - 10.1002/chem.201604340

M3 - Article

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AN - SCOPUS:85006852922

VL - 23

SP - 1278

EP - 1290

JO - Chemistry - A European Journal

JF - Chemistry - A European Journal

SN - 0947-6539

IS - 6

ER -