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Three-dimensional organic–inorganic hybrid sodium halide perovskite: C(4)H(12)N(2)·NaI(3) and a hydrogen-bonded supra­molecular three-dimensional network in 3C(4)H(12)N(2)·NaI(4)·3I·H(2)O

The rational selection of ligands is vitally important in the construction of new organic–inorganic hybrid three-dimensional perovskite complexes. As part of an exploration of perovskite-type materials, two new Na–I compounds based on the piperazine ligand, namely poly[piperazinediium [tri-μ-iodido-...

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Autores principales: Chen, Xiao-Gang, Gao, Ji-Xing, Hua, Xiu-Ni, Liao, Wei-Qiang
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2018
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5987734/
https://www.ncbi.nlm.nih.gov/pubmed/29870009
http://dx.doi.org/10.1107/S2053229618006885
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author Chen, Xiao-Gang
Gao, Ji-Xing
Hua, Xiu-Ni
Liao, Wei-Qiang
author_facet Chen, Xiao-Gang
Gao, Ji-Xing
Hua, Xiu-Ni
Liao, Wei-Qiang
author_sort Chen, Xiao-Gang
collection PubMed
description The rational selection of ligands is vitally important in the construction of new organic–inorganic hybrid three-dimensional perovskite complexes. As part of an exploration of perovskite-type materials, two new Na–I compounds based on the piperazine ligand, namely poly[piperazinediium [tri-μ-iodido-sodium]], {(C(4)H(12)N(2))[NaI(3)]}(n), 1, and catena-poly[tris­(piperazinediium) [[tri­iodido­sodium]-μ-iodido] triiodide monohydrate], {(C(4)H(12)N(2))(3)[NaI(4)]I(3)·H(2)O}(n), 2, have been synthesized by adjusting the stoichiometric ratio of sodium iodide and piperazine, and were characterized by single-crystal X-ray diffraction. In the crystal structures of 1 and 2, each Na(I) cation is linked to six I atoms, but the compounds show completely different configurations. In 1, the structure includes a perovskite-like array of vertex-sharing NaI(6) octa­hedra stretching along the direction of the three axes, and each piperazinediium dication is enclosed in the NaI(3) perovskite cage. However, in 2, each Na(I) atom bridges a single I atom to form a one-dimensional linear chain, and complex inter­molecular hydrogen bonds connect these one-dimensional chains into a three-dimensional supra­molecular network.
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spelling pubmed-59877342018-06-06 Three-dimensional organic–inorganic hybrid sodium halide perovskite: C(4)H(12)N(2)·NaI(3) and a hydrogen-bonded supra­molecular three-dimensional network in 3C(4)H(12)N(2)·NaI(4)·3I·H(2)O Chen, Xiao-Gang Gao, Ji-Xing Hua, Xiu-Ni Liao, Wei-Qiang Acta Crystallogr C Struct Chem Research Papers The rational selection of ligands is vitally important in the construction of new organic–inorganic hybrid three-dimensional perovskite complexes. As part of an exploration of perovskite-type materials, two new Na–I compounds based on the piperazine ligand, namely poly[piperazinediium [tri-μ-iodido-sodium]], {(C(4)H(12)N(2))[NaI(3)]}(n), 1, and catena-poly[tris­(piperazinediium) [[tri­iodido­sodium]-μ-iodido] triiodide monohydrate], {(C(4)H(12)N(2))(3)[NaI(4)]I(3)·H(2)O}(n), 2, have been synthesized by adjusting the stoichiometric ratio of sodium iodide and piperazine, and were characterized by single-crystal X-ray diffraction. In the crystal structures of 1 and 2, each Na(I) cation is linked to six I atoms, but the compounds show completely different configurations. In 1, the structure includes a perovskite-like array of vertex-sharing NaI(6) octa­hedra stretching along the direction of the three axes, and each piperazinediium dication is enclosed in the NaI(3) perovskite cage. However, in 2, each Na(I) atom bridges a single I atom to form a one-dimensional linear chain, and complex inter­molecular hydrogen bonds connect these one-dimensional chains into a three-dimensional supra­molecular network. International Union of Crystallography 2018-05-23 /pmc/articles/PMC5987734/ /pubmed/29870009 http://dx.doi.org/10.1107/S2053229618006885 Text en © Chen 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 Papers
Chen, Xiao-Gang
Gao, Ji-Xing
Hua, Xiu-Ni
Liao, Wei-Qiang
Three-dimensional organic–inorganic hybrid sodium halide perovskite: C(4)H(12)N(2)·NaI(3) and a hydrogen-bonded supra­molecular three-dimensional network in 3C(4)H(12)N(2)·NaI(4)·3I·H(2)O
title Three-dimensional organic–inorganic hybrid sodium halide perovskite: C(4)H(12)N(2)·NaI(3) and a hydrogen-bonded supra­molecular three-dimensional network in 3C(4)H(12)N(2)·NaI(4)·3I·H(2)O
title_full Three-dimensional organic–inorganic hybrid sodium halide perovskite: C(4)H(12)N(2)·NaI(3) and a hydrogen-bonded supra­molecular three-dimensional network in 3C(4)H(12)N(2)·NaI(4)·3I·H(2)O
title_fullStr Three-dimensional organic–inorganic hybrid sodium halide perovskite: C(4)H(12)N(2)·NaI(3) and a hydrogen-bonded supra­molecular three-dimensional network in 3C(4)H(12)N(2)·NaI(4)·3I·H(2)O
title_full_unstemmed Three-dimensional organic–inorganic hybrid sodium halide perovskite: C(4)H(12)N(2)·NaI(3) and a hydrogen-bonded supra­molecular three-dimensional network in 3C(4)H(12)N(2)·NaI(4)·3I·H(2)O
title_short Three-dimensional organic–inorganic hybrid sodium halide perovskite: C(4)H(12)N(2)·NaI(3) and a hydrogen-bonded supra­molecular three-dimensional network in 3C(4)H(12)N(2)·NaI(4)·3I·H(2)O
title_sort three-dimensional organic–inorganic hybrid sodium halide perovskite: c(4)h(12)n(2)·nai(3) and a hydrogen-bonded supra­molecular three-dimensional network in 3c(4)h(12)n(2)·nai(4)·3i·h(2)o
topic Research Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5987734/
https://www.ncbi.nlm.nih.gov/pubmed/29870009
http://dx.doi.org/10.1107/S2053229618006885
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