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Penta­carbonyl-1κ(2) C,2κ(3) C-(ferrocenyl­diphenyl­phosphine-1κP)[μ-2-(4-methyl­phen­yl)-2-aza­propane-1,3-dithiol­ato-1:2κ(4) S,S′:S,S′]diiron(I)(Fe—Fe)

The title compound, [Fe(2)(C(9)H(11)NS(2)){Fe(C(5)H(5))(C(17)H(14)P)}(CO)(5)], was prepared as an aza­dithiol­ato–iron model for the iron-only hydrogenase active site. The Fe(2)S(2) unit exhibits a butterfly conformation and the ferrocenyldiphenyl­phosphine ligand is trans to the Fe—Fe bond. The Fe—...

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Detalles Bibliográficos
Autores principales: Tang, Yan-Feng, Zhu, Jin-Li
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2008
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2959581/
https://www.ncbi.nlm.nih.gov/pubmed/21580868
http://dx.doi.org/10.1107/S1600536808032698
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author Tang, Yan-Feng
Zhu, Jin-Li
author_facet Tang, Yan-Feng
Zhu, Jin-Li
author_sort Tang, Yan-Feng
collection PubMed
description The title compound, [Fe(2)(C(9)H(11)NS(2)){Fe(C(5)H(5))(C(17)H(14)P)}(CO)(5)], was prepared as an aza­dithiol­ato–iron model for the iron-only hydrogenase active site. The Fe(2)S(2) unit exhibits a butterfly conformation and the ferrocenyldiphenyl­phosphine ligand is trans to the Fe—Fe bond. The Fe—Fe distance of 2.5160 (8) Å is longer than found in related model structures. Intra­molecular C—H⋯S and inter­molecular C—H⋯O hydrogen bonds are observed.
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spelling pubmed-29595812010-12-30 Penta­carbonyl-1κ(2) C,2κ(3) C-(ferrocenyl­diphenyl­phosphine-1κP)[μ-2-(4-methyl­phen­yl)-2-aza­propane-1,3-dithiol­ato-1:2κ(4) S,S′:S,S′]diiron(I)(Fe—Fe) Tang, Yan-Feng Zhu, Jin-Li Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers The title compound, [Fe(2)(C(9)H(11)NS(2)){Fe(C(5)H(5))(C(17)H(14)P)}(CO)(5)], was prepared as an aza­dithiol­ato–iron model for the iron-only hydrogenase active site. The Fe(2)S(2) unit exhibits a butterfly conformation and the ferrocenyldiphenyl­phosphine ligand is trans to the Fe—Fe bond. The Fe—Fe distance of 2.5160 (8) Å is longer than found in related model structures. Intra­molecular C—H⋯S and inter­molecular C—H⋯O hydrogen bonds are observed. International Union of Crystallography 2008-10-18 /pmc/articles/PMC2959581/ /pubmed/21580868 http://dx.doi.org/10.1107/S1600536808032698 Text en © Tang and Zhu 2008 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.
spellingShingle Metal-Organic Papers
Tang, Yan-Feng
Zhu, Jin-Li
Penta­carbonyl-1κ(2) C,2κ(3) C-(ferrocenyl­diphenyl­phosphine-1κP)[μ-2-(4-methyl­phen­yl)-2-aza­propane-1,3-dithiol­ato-1:2κ(4) S,S′:S,S′]diiron(I)(Fe—Fe)
title Penta­carbonyl-1κ(2) C,2κ(3) C-(ferrocenyl­diphenyl­phosphine-1κP)[μ-2-(4-methyl­phen­yl)-2-aza­propane-1,3-dithiol­ato-1:2κ(4) S,S′:S,S′]diiron(I)(Fe—Fe)
title_full Penta­carbonyl-1κ(2) C,2κ(3) C-(ferrocenyl­diphenyl­phosphine-1κP)[μ-2-(4-methyl­phen­yl)-2-aza­propane-1,3-dithiol­ato-1:2κ(4) S,S′:S,S′]diiron(I)(Fe—Fe)
title_fullStr Penta­carbonyl-1κ(2) C,2κ(3) C-(ferrocenyl­diphenyl­phosphine-1κP)[μ-2-(4-methyl­phen­yl)-2-aza­propane-1,3-dithiol­ato-1:2κ(4) S,S′:S,S′]diiron(I)(Fe—Fe)
title_full_unstemmed Penta­carbonyl-1κ(2) C,2κ(3) C-(ferrocenyl­diphenyl­phosphine-1κP)[μ-2-(4-methyl­phen­yl)-2-aza­propane-1,3-dithiol­ato-1:2κ(4) S,S′:S,S′]diiron(I)(Fe—Fe)
title_short Penta­carbonyl-1κ(2) C,2κ(3) C-(ferrocenyl­diphenyl­phosphine-1κP)[μ-2-(4-methyl­phen­yl)-2-aza­propane-1,3-dithiol­ato-1:2κ(4) S,S′:S,S′]diiron(I)(Fe—Fe)
title_sort penta­carbonyl-1κ(2) c,2κ(3) c-(ferrocenyl­diphenyl­phosphine-1κp)[μ-2-(4-methyl­phen­yl)-2-aza­propane-1,3-dithiol­ato-1:2κ(4) s,s′:s,s′]diiron(i)(fe—fe)
topic Metal-Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2959581/
https://www.ncbi.nlm.nih.gov/pubmed/21580868
http://dx.doi.org/10.1107/S1600536808032698
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