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Synthesis, crystal structure and Hirshfeld surface analysis of catena-poly[[bis(semicarbazide-κ(2) N,O)copper(II)]-μ-sulfato-κ(2) O:O′]
The title polymer, [Cu(SO(4))(CH(5)N(3)O)(2)]( n ), has been synthesized from aqueous solutions of CuSO(4) and semicarbazide. In the crystal structure, the Cu(II) atoms are chelated by two neutral semicarbazide molecules through the oxygen atom and a nitrogen atom of the amino group. The remaining...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2022
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9638975/ https://www.ncbi.nlm.nih.gov/pubmed/36380913 http://dx.doi.org/10.1107/S2056989022010040 |
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author | Tadjieva, Galiya Ibragimov, Aziz B. Yakubov, Yuldash Ibragimov, Bakhtiyar T. Ashurov, Jamshid M. |
author_facet | Tadjieva, Galiya Ibragimov, Aziz B. Yakubov, Yuldash Ibragimov, Bakhtiyar T. Ashurov, Jamshid M. |
author_sort | Tadjieva, Galiya |
collection | PubMed |
description | The title polymer, [Cu(SO(4))(CH(5)N(3)O)(2)]( n ), has been synthesized from aqueous solutions of CuSO(4) and semicarbazide. In the crystal structure, the Cu(II) atoms are chelated by two neutral semicarbazide molecules through the oxygen atom and a nitrogen atom of the amino group. The remaining two positions of the Jahn–Teller-distorted octahedral coordination sphere are occupied by oxygen atoms of two sulfate anions in the axial positions. The coordination bonds of the latter associate the polyhedra into polymeric chains running parallel to the c axis. There is a weak intramolecular hydrogen bond between the N—H group and an oxygen atom of the SO(4) (2–) anion. Thirteen relatively weak intermolecular hydrogen-bonding interactions link the chains into a three-dimensional network. Hirshfeld surface analysis revealed that 64.7% of the intermolecular interactions are from O⋯H/H⋯O contacts and 20.1% from H⋯H contacts. Other interactions such as N⋯H/H⋯N or C⋯H/H⋯C contribute less to the crystal packing. |
format | Online Article Text |
id | pubmed-9638975 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2022 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-96389752022-11-14 Synthesis, crystal structure and Hirshfeld surface analysis of catena-poly[[bis(semicarbazide-κ(2) N,O)copper(II)]-μ-sulfato-κ(2) O:O′] Tadjieva, Galiya Ibragimov, Aziz B. Yakubov, Yuldash Ibragimov, Bakhtiyar T. Ashurov, Jamshid M. Acta Crystallogr E Crystallogr Commun Research Communications The title polymer, [Cu(SO(4))(CH(5)N(3)O)(2)]( n ), has been synthesized from aqueous solutions of CuSO(4) and semicarbazide. In the crystal structure, the Cu(II) atoms are chelated by two neutral semicarbazide molecules through the oxygen atom and a nitrogen atom of the amino group. The remaining two positions of the Jahn–Teller-distorted octahedral coordination sphere are occupied by oxygen atoms of two sulfate anions in the axial positions. The coordination bonds of the latter associate the polyhedra into polymeric chains running parallel to the c axis. There is a weak intramolecular hydrogen bond between the N—H group and an oxygen atom of the SO(4) (2–) anion. Thirteen relatively weak intermolecular hydrogen-bonding interactions link the chains into a three-dimensional network. Hirshfeld surface analysis revealed that 64.7% of the intermolecular interactions are from O⋯H/H⋯O contacts and 20.1% from H⋯H contacts. Other interactions such as N⋯H/H⋯N or C⋯H/H⋯C contribute less to the crystal packing. International Union of Crystallography 2022-10-20 /pmc/articles/PMC9638975/ /pubmed/36380913 http://dx.doi.org/10.1107/S2056989022010040 Text en © Tadjieva et al. 2022 https://creativecommons.org/licenses/by/4.0/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. |
spellingShingle | Research Communications Tadjieva, Galiya Ibragimov, Aziz B. Yakubov, Yuldash Ibragimov, Bakhtiyar T. Ashurov, Jamshid M. Synthesis, crystal structure and Hirshfeld surface analysis of catena-poly[[bis(semicarbazide-κ(2) N,O)copper(II)]-μ-sulfato-κ(2) O:O′] |
title | Synthesis, crystal structure and Hirshfeld surface analysis of catena-poly[[bis(semicarbazide-κ(2)
N,O)copper(II)]-μ-sulfato-κ(2)
O:O′] |
title_full | Synthesis, crystal structure and Hirshfeld surface analysis of catena-poly[[bis(semicarbazide-κ(2)
N,O)copper(II)]-μ-sulfato-κ(2)
O:O′] |
title_fullStr | Synthesis, crystal structure and Hirshfeld surface analysis of catena-poly[[bis(semicarbazide-κ(2)
N,O)copper(II)]-μ-sulfato-κ(2)
O:O′] |
title_full_unstemmed | Synthesis, crystal structure and Hirshfeld surface analysis of catena-poly[[bis(semicarbazide-κ(2)
N,O)copper(II)]-μ-sulfato-κ(2)
O:O′] |
title_short | Synthesis, crystal structure and Hirshfeld surface analysis of catena-poly[[bis(semicarbazide-κ(2)
N,O)copper(II)]-μ-sulfato-κ(2)
O:O′] |
title_sort | synthesis, crystal structure and hirshfeld surface analysis of catena-poly[[bis(semicarbazide-κ(2)
n,o)copper(ii)]-μ-sulfato-κ(2)
o:o′] |
topic | Research Communications |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9638975/ https://www.ncbi.nlm.nih.gov/pubmed/36380913 http://dx.doi.org/10.1107/S2056989022010040 |
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