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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...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2012
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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). |
format | Online Article Text |
id | pubmed-3414135 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2012 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
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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