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Dicarbon­yl(η(5)-cyclo­penta­dien­yl)(hexa­methyl­enetetra­mine-κN (1))iron(II) tetra­fluoridoborate

In the structure of the title compound, [Fe(C(5)H(5))(C(6)H(12)N(4))(CO)(2)]BF(4), the arrangement around the Fe(II) atom corresponds to that of a three-legged piano stool. The cyclo­penta­dienyl ligand occupies three coordination sites of the apical position in a η(5) fashion, while two CO ligands...

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Autores principales: M’thiruaine, Cyprian M., Friedrich, Holger B., Omondi, Bernard
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3414135/
https://www.ncbi.nlm.nih.gov/pubmed/22904742
http://dx.doi.org/10.1107/S1600536812031649
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author M’thiruaine, Cyprian M.
Friedrich, Holger B.
Omondi, Bernard
author_facet M’thiruaine, Cyprian M.
Friedrich, Holger B.
Omondi, Bernard
author_sort M’thiruaine, Cyprian M.
collection PubMed
description In the structure of the title compound, [Fe(C(5)H(5))(C(6)H(12)N(4))(CO)(2)]BF(4), the arrangement around the Fe(II) atom corresponds to that of a three-legged piano stool. The cyclo­penta­dienyl ligand occupies three coordination sites of the apical position in a η(5) fashion, while two CO ligands and one N atom of the hexa­methyl­ene­tetra­mine ligand occupy the remaining coordination sites to complete a distorted octa­hedral geometry. The asymmetric unit consists of two sets of crystallographically independent cations and anions with the r.m.s. deviations of the overlay of non-H atoms of each pair being 0.081 and 0.120 Å, respectively. The Fe—N bond lengths are 2.0459 (15) and 2.0490 (14) Å, while the Fe—Cp(centroid) distances are 1.7257 (3) and 1.7246 (3) Å. One of the anions displays disorder, with the F atoms having occupancies of 0.58 (4) and 0.42 (4).
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spelling pubmed-34141352012-08-17 Dicarbon­yl(η(5)-cyclo­penta­dien­yl)(hexa­methyl­enetetra­mine-κN (1))iron(II) tetra­fluoridoborate M’thiruaine, Cyprian M. Friedrich, Holger B. Omondi, Bernard Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers In the structure of the title compound, [Fe(C(5)H(5))(C(6)H(12)N(4))(CO)(2)]BF(4), the arrangement around the Fe(II) atom corresponds to that of a three-legged piano stool. The cyclo­penta­dienyl ligand occupies three coordination sites of the apical position in a η(5) fashion, while two CO ligands and one N atom of the hexa­methyl­ene­tetra­mine ligand occupy the remaining coordination sites to complete a distorted octa­hedral geometry. The asymmetric unit consists of two sets of crystallographically independent cations and anions with the r.m.s. deviations of the overlay of non-H atoms of each pair being 0.081 and 0.120 Å, respectively. The Fe—N bond lengths are 2.0459 (15) and 2.0490 (14) Å, while the Fe—Cp(centroid) distances are 1.7257 (3) and 1.7246 (3) Å. One of the anions displays disorder, with the F atoms having occupancies of 0.58 (4) and 0.42 (4). International Union of Crystallography 2012-07-18 /pmc/articles/PMC3414135/ /pubmed/22904742 http://dx.doi.org/10.1107/S1600536812031649 Text en © M'thiruaine et al. 2012 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
M’thiruaine, Cyprian M.
Friedrich, Holger B.
Omondi, Bernard
Dicarbon­yl(η(5)-cyclo­penta­dien­yl)(hexa­methyl­enetetra­mine-κN (1))iron(II) tetra­fluoridoborate
title Dicarbon­yl(η(5)-cyclo­penta­dien­yl)(hexa­methyl­enetetra­mine-κN (1))iron(II) tetra­fluoridoborate
title_full Dicarbon­yl(η(5)-cyclo­penta­dien­yl)(hexa­methyl­enetetra­mine-κN (1))iron(II) tetra­fluoridoborate
title_fullStr Dicarbon­yl(η(5)-cyclo­penta­dien­yl)(hexa­methyl­enetetra­mine-κN (1))iron(II) tetra­fluoridoborate
title_full_unstemmed Dicarbon­yl(η(5)-cyclo­penta­dien­yl)(hexa­methyl­enetetra­mine-κN (1))iron(II) tetra­fluoridoborate
title_short Dicarbon­yl(η(5)-cyclo­penta­dien­yl)(hexa­methyl­enetetra­mine-κN (1))iron(II) tetra­fluoridoborate
title_sort dicarbon­yl(η(5)-cyclo­penta­dien­yl)(hexa­methyl­enetetra­mine-κn (1))iron(ii) tetra­fluoridoborate
topic Metal-Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3414135/
https://www.ncbi.nlm.nih.gov/pubmed/22904742
http://dx.doi.org/10.1107/S1600536812031649
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