Cargando…

(Carbonyl-1κC)bis­[2,3(η(5))-cyclo­penta­dien­yl][μ(3)-(S-methyl trithio­carbonato)methylidyne-1:2:3κ(4) C,S′′:C:C](triphenyl­phosphine-1κP)(μ(3)-sulfido-1:2:3κ(3) S)dicobalt(II)iron(II) trifluoro­methane­sulfonate

The asymmetric unit of the title compound, [FeCo(2)(C(5)H(5))(2)(C(3)H(3)S(3))S(C(18)H(15)P)(CO)]CF(3)SO(3), consists of a triangular irondicobalt cluster cation and a trifluoro­methane­sulfonate anion. In the cation, the FeCo(2) triangle is symmetrically capped on one face by an S atom and on the o...

Descripción completa

Detalles Bibliográficos
Autores principales: Manning, Anthony R., McAdam, C. John, Palmer, Anthony J., Simpson, Jim
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2008
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2961332/
https://www.ncbi.nlm.nih.gov/pubmed/21202187
http://dx.doi.org/10.1107/S1600536808008970
_version_ 1782188957383000064
author Manning, Anthony R.
McAdam, C. John
Palmer, Anthony J.
Simpson, Jim
author_facet Manning, Anthony R.
McAdam, C. John
Palmer, Anthony J.
Simpson, Jim
author_sort Manning, Anthony R.
collection PubMed
description The asymmetric unit of the title compound, [FeCo(2)(C(5)H(5))(2)(C(3)H(3)S(3))S(C(18)H(15)P)(CO)]CF(3)SO(3), consists of a triangular irondicobalt cluster cation and a trifluoro­methane­sulfonate anion. In the cation, the FeCo(2) triangle is symmetrically capped on one face by an S atom and on the other by a C atom linked to a methyl trithio­carbonate residue that bridges the Fe—C bond. Each Co atom carries a cyclo­penta­dienyl ligand while the Fe atom coordinates to one carbonyl and one triphenyl­phosphine ligand. In the crystal structure, the cation is linked to the anion by a number of weak non-classical C—H⋯O and C—H⋯F hydrogen bonds and weak S⋯O (3.317 Å) and S⋯F (3.198 Å) inter­actions. The structure is further stabilized by additional inter­molecular C—H⋯O, C—H⋯F and O⋯O (2.942 Å) contacts, together with an unusual S⋯π(Cp) inter­action (S⋯centroid distance = 3.385 Å), generating an extended network.
format Text
id pubmed-2961332
institution National Center for Biotechnology Information
language English
publishDate 2008
publisher International Union of Crystallography
record_format MEDLINE/PubMed
spelling pubmed-29613322010-12-30 (Carbonyl-1κC)bis­[2,3(η(5))-cyclo­penta­dien­yl][μ(3)-(S-methyl trithio­carbonato)methylidyne-1:2:3κ(4) C,S′′:C:C](triphenyl­phosphine-1κP)(μ(3)-sulfido-1:2:3κ(3) S)dicobalt(II)iron(II) trifluoro­methane­sulfonate Manning, Anthony R. McAdam, C. John Palmer, Anthony J. Simpson, Jim Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers The asymmetric unit of the title compound, [FeCo(2)(C(5)H(5))(2)(C(3)H(3)S(3))S(C(18)H(15)P)(CO)]CF(3)SO(3), consists of a triangular irondicobalt cluster cation and a trifluoro­methane­sulfonate anion. In the cation, the FeCo(2) triangle is symmetrically capped on one face by an S atom and on the other by a C atom linked to a methyl trithio­carbonate residue that bridges the Fe—C bond. Each Co atom carries a cyclo­penta­dienyl ligand while the Fe atom coordinates to one carbonyl and one triphenyl­phosphine ligand. In the crystal structure, the cation is linked to the anion by a number of weak non-classical C—H⋯O and C—H⋯F hydrogen bonds and weak S⋯O (3.317 Å) and S⋯F (3.198 Å) inter­actions. The structure is further stabilized by additional inter­molecular C—H⋯O, C—H⋯F and O⋯O (2.942 Å) contacts, together with an unusual S⋯π(Cp) inter­action (S⋯centroid distance = 3.385 Å), generating an extended network. International Union of Crystallography 2008-04-10 /pmc/articles/PMC2961332/ /pubmed/21202187 http://dx.doi.org/10.1107/S1600536808008970 Text en © Manning et al. 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
Manning, Anthony R.
McAdam, C. John
Palmer, Anthony J.
Simpson, Jim
(Carbonyl-1κC)bis­[2,3(η(5))-cyclo­penta­dien­yl][μ(3)-(S-methyl trithio­carbonato)methylidyne-1:2:3κ(4) C,S′′:C:C](triphenyl­phosphine-1κP)(μ(3)-sulfido-1:2:3κ(3) S)dicobalt(II)iron(II) trifluoro­methane­sulfonate
title (Carbonyl-1κC)bis­[2,3(η(5))-cyclo­penta­dien­yl][μ(3)-(S-methyl trithio­carbonato)methylidyne-1:2:3κ(4) C,S′′:C:C](triphenyl­phosphine-1κP)(μ(3)-sulfido-1:2:3κ(3) S)dicobalt(II)iron(II) trifluoro­methane­sulfonate
title_full (Carbonyl-1κC)bis­[2,3(η(5))-cyclo­penta­dien­yl][μ(3)-(S-methyl trithio­carbonato)methylidyne-1:2:3κ(4) C,S′′:C:C](triphenyl­phosphine-1κP)(μ(3)-sulfido-1:2:3κ(3) S)dicobalt(II)iron(II) trifluoro­methane­sulfonate
title_fullStr (Carbonyl-1κC)bis­[2,3(η(5))-cyclo­penta­dien­yl][μ(3)-(S-methyl trithio­carbonato)methylidyne-1:2:3κ(4) C,S′′:C:C](triphenyl­phosphine-1κP)(μ(3)-sulfido-1:2:3κ(3) S)dicobalt(II)iron(II) trifluoro­methane­sulfonate
title_full_unstemmed (Carbonyl-1κC)bis­[2,3(η(5))-cyclo­penta­dien­yl][μ(3)-(S-methyl trithio­carbonato)methylidyne-1:2:3κ(4) C,S′′:C:C](triphenyl­phosphine-1κP)(μ(3)-sulfido-1:2:3κ(3) S)dicobalt(II)iron(II) trifluoro­methane­sulfonate
title_short (Carbonyl-1κC)bis­[2,3(η(5))-cyclo­penta­dien­yl][μ(3)-(S-methyl trithio­carbonato)methylidyne-1:2:3κ(4) C,S′′:C:C](triphenyl­phosphine-1κP)(μ(3)-sulfido-1:2:3κ(3) S)dicobalt(II)iron(II) trifluoro­methane­sulfonate
title_sort (carbonyl-1κc)bis­[2,3(η(5))-cyclo­penta­dien­yl][μ(3)-(s-methyl trithio­carbonato)methylidyne-1:2:3κ(4) c,s′′:c:c](triphenyl­phosphine-1κp)(μ(3)-sulfido-1:2:3κ(3) s)dicobalt(ii)iron(ii) trifluoro­methane­sulfonate
topic Metal-Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2961332/
https://www.ncbi.nlm.nih.gov/pubmed/21202187
http://dx.doi.org/10.1107/S1600536808008970
work_keys_str_mv AT manninganthonyr carbonyl1kcbis23ē5cyclopentadienylm3smethyltrithiocarbonatomethylidyne123k4cscctriphenylphosphine1kpm3sulfido123k3sdicobaltiiironiitrifluoromethanesulfonate
AT mcadamcjohn carbonyl1kcbis23ē5cyclopentadienylm3smethyltrithiocarbonatomethylidyne123k4cscctriphenylphosphine1kpm3sulfido123k3sdicobaltiiironiitrifluoromethanesulfonate
AT palmeranthonyj carbonyl1kcbis23ē5cyclopentadienylm3smethyltrithiocarbonatomethylidyne123k4cscctriphenylphosphine1kpm3sulfido123k3sdicobaltiiironiitrifluoromethanesulfonate
AT simpsonjim carbonyl1kcbis23ē5cyclopentadienylm3smethyltrithiocarbonatomethylidyne123k4cscctriphenylphosphine1kpm3sulfido123k3sdicobaltiiironiitrifluoromethanesulfonate