Penta­zirconium copper tribismuth

Penta­zirconium copper tribismuth, Zr(5)CuBi(3), crystallizes in the hexa­gonal Hf(5)CuSn(3) structure type. The asymmetric unit contains two Zr sites (site symmetries 3.2 and m2m), one Cu site (site symmetry 3.m) and one Bi site (site symmetry m2m). The environment of the Bi atoms is a tetra­gonal...

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Autores principales: Balinska, Agnieszka, Tarasiuk, Ivan, Pavlyuk, Volodymyr
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2013
Materias:
Inorganic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3793669/
https://www.ncbi.nlm.nih.gov/pubmed/24109256
http://dx.doi.org/10.1107/S1600536813019235
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author Balinska, Agnieszka
Tarasiuk, Ivan
Pavlyuk, Volodymyr
author_facet Balinska, Agnieszka
Tarasiuk, Ivan
Pavlyuk, Volodymyr
author_sort Balinska, Agnieszka
collection PubMed
description Penta­zirconium copper tribismuth, Zr(5)CuBi(3), crystallizes in the hexa­gonal Hf(5)CuSn(3) structure type. The asymmetric unit contains two Zr sites (site symmetries 3.2 and m2m), one Cu site (site symmetry 3.m) and one Bi site (site symmetry m2m). The environment of the Bi atoms is a tetra­gonal anti­prism with one added atom and a coordination number (CN) of 9. The polyhedron around the Zr1 atom is a defective cubo­octa­hedron with CN = 11. The bicapped hexa­gonal anti­prism (CN = 14) is typical for Zr2 atoms. The Cu atom is enclosed in a eight-vertex polyhedron (octa­hedron with two centered faces). The metallic type of bonding was indicated by an analysis of the inter­atomic distances and electronic structure calculation data.
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spelling pubmed-37936692013-10-09 Penta­zirconium copper tribismuth Balinska, Agnieszka Tarasiuk, Ivan Pavlyuk, Volodymyr Acta Crystallogr Sect E Struct Rep Online Inorganic Papers Penta­zirconium copper tribismuth, Zr(5)CuBi(3), crystallizes in the hexa­gonal Hf(5)CuSn(3) structure type. The asymmetric unit contains two Zr sites (site symmetries 3.2 and m2m), one Cu site (site symmetry 3.m) and one Bi site (site symmetry m2m). The environment of the Bi atoms is a tetra­gonal anti­prism with one added atom and a coordination number (CN) of 9. The polyhedron around the Zr1 atom is a defective cubo­octa­hedron with CN = 11. The bicapped hexa­gonal anti­prism (CN = 14) is typical for Zr2 atoms. The Cu atom is enclosed in a eight-vertex polyhedron (octa­hedron with two centered faces). The metallic type of bonding was indicated by an analysis of the inter­atomic distances and electronic structure calculation data. International Union of Crystallography 2013-07-17 /pmc/articles/PMC3793669/ /pubmed/24109256 http://dx.doi.org/10.1107/S1600536813019235 Text en © Balinska et al. 2013 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 Inorganic Papers
Balinska, Agnieszka
Tarasiuk, Ivan
Pavlyuk, Volodymyr
Penta­zirconium copper tribismuth
title Penta­zirconium copper tribismuth
title_full Penta­zirconium copper tribismuth
title_fullStr Penta­zirconium copper tribismuth
title_full_unstemmed Penta­zirconium copper tribismuth
title_short Penta­zirconium copper tribismuth
title_sort penta­zirconium copper tribismuth
topic Inorganic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3793669/
https://www.ncbi.nlm.nih.gov/pubmed/24109256
http://dx.doi.org/10.1107/S1600536813019235
work_keys_str_mv AT balinskaagnieszka pentazirconiumcoppertribismuth
AT tarasiukivan pentazirconiumcoppertribismuth
AT pavlyukvolodymyr pentazirconiumcoppertribismuth

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