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Redetermination of the crystal structure of bis(tri-2-pyridylamine)iron(II) bis(perchlorate), and a new refinement of the isotypic nickel(II) analogue: treatment of the perchlorate anion disorder
The redetermination of the structure of the title compound, [Fe(C(15)H(12)N(4))(2)](ClO(4))(2), (I), confirms the structure previously reported [Kucharski et al. (1978a ▸). Aust. J. Chem. 31, 53–56], but models the perchlorate over four sets of atomic sites, rather than using just one set of sites a...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
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International Union of Crystallography
2018
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5947484/ https://www.ncbi.nlm.nih.gov/pubmed/29850088 http://dx.doi.org/10.1107/S2056989018005601 |
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author | Setifi, Zouaoui Setifi, Fatima Dege, Necmi El Ati, Rafika Glidewell, Christopher |
author_facet | Setifi, Zouaoui Setifi, Fatima Dege, Necmi El Ati, Rafika Glidewell, Christopher |
author_sort | Setifi, Zouaoui |
collection | PubMed |
description | The redetermination of the structure of the title compound, [Fe(C(15)H(12)N(4))(2)](ClO(4))(2), (I), confirms the structure previously reported [Kucharski et al. (1978a ▸). Aust. J. Chem. 31, 53–56], but models the perchlorate over four sets of atomic sites, rather than using just one set of sites as in the original report. The supramolecular assembly, not reported previously, takes the form of a complex three-dimensional framework built from C—H⋯O hydrogen bonds. The isotypic nickel(II) analogue, [Ni(C(15)H(12)N(4))(2)](ClO(4))(2), (III), has been refined using the original data set [Wang et al. (2011 ▸). Acta Cryst. E67, m78], again using a four-component disorder model for the anion, rather than a two-component model as in the original report, leading to more satisfactory Cl—O distances and O—Cl—O angles. |
format | Online Article Text |
id | pubmed-5947484 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2018 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-59474842018-05-30 Redetermination of the crystal structure of bis(tri-2-pyridylamine)iron(II) bis(perchlorate), and a new refinement of the isotypic nickel(II) analogue: treatment of the perchlorate anion disorder Setifi, Zouaoui Setifi, Fatima Dege, Necmi El Ati, Rafika Glidewell, Christopher Acta Crystallogr E Crystallogr Commun Research Communications The redetermination of the structure of the title compound, [Fe(C(15)H(12)N(4))(2)](ClO(4))(2), (I), confirms the structure previously reported [Kucharski et al. (1978a ▸). Aust. J. Chem. 31, 53–56], but models the perchlorate over four sets of atomic sites, rather than using just one set of sites as in the original report. The supramolecular assembly, not reported previously, takes the form of a complex three-dimensional framework built from C—H⋯O hydrogen bonds. The isotypic nickel(II) analogue, [Ni(C(15)H(12)N(4))(2)](ClO(4))(2), (III), has been refined using the original data set [Wang et al. (2011 ▸). Acta Cryst. E67, m78], again using a four-component disorder model for the anion, rather than a two-component model as in the original report, leading to more satisfactory Cl—O distances and O—Cl—O angles. International Union of Crystallography 2018-04-17 /pmc/articles/PMC5947484/ /pubmed/29850088 http://dx.doi.org/10.1107/S2056989018005601 Text en © Setifi et al. 2018 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.http://creativecommons.org/licenses/by/2.0/uk/ |
spellingShingle | Research Communications Setifi, Zouaoui Setifi, Fatima Dege, Necmi El Ati, Rafika Glidewell, Christopher Redetermination of the crystal structure of bis(tri-2-pyridylamine)iron(II) bis(perchlorate), and a new refinement of the isotypic nickel(II) analogue: treatment of the perchlorate anion disorder |
title | Redetermination of the crystal structure of bis(tri-2-pyridylamine)iron(II) bis(perchlorate), and a new refinement of the isotypic nickel(II) analogue: treatment of the perchlorate anion disorder |
title_full | Redetermination of the crystal structure of bis(tri-2-pyridylamine)iron(II) bis(perchlorate), and a new refinement of the isotypic nickel(II) analogue: treatment of the perchlorate anion disorder |
title_fullStr | Redetermination of the crystal structure of bis(tri-2-pyridylamine)iron(II) bis(perchlorate), and a new refinement of the isotypic nickel(II) analogue: treatment of the perchlorate anion disorder |
title_full_unstemmed | Redetermination of the crystal structure of bis(tri-2-pyridylamine)iron(II) bis(perchlorate), and a new refinement of the isotypic nickel(II) analogue: treatment of the perchlorate anion disorder |
title_short | Redetermination of the crystal structure of bis(tri-2-pyridylamine)iron(II) bis(perchlorate), and a new refinement of the isotypic nickel(II) analogue: treatment of the perchlorate anion disorder |
title_sort | redetermination of the crystal structure of bis(tri-2-pyridylamine)iron(ii) bis(perchlorate), and a new refinement of the isotypic nickel(ii) analogue: treatment of the perchlorate anion disorder |
topic | Research Communications |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5947484/ https://www.ncbi.nlm.nih.gov/pubmed/29850088 http://dx.doi.org/10.1107/S2056989018005601 |
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