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Crystal structure of dichlorido-1κCl,2κCl-(μ(2)-3,5-dimethyl-1H-pyrazolato-1κN (2):2κN (1))(3,5-dimethyl-1H-pyrazole-2κN (2)){μ-2-[(2-hydroxyethyl)amino-1κ(2) N,O]ethanolato-1:2κ(2) O:O}dicopper(II)
The title compound, [Cu(2)(C(5)H(7)N(2))(C(4)H(10)NO(2))Cl(2)(C(5)H(8)N(2))], is a pyrazolate aminoalcohol complex which contains two dimethylpyrazole molecules in monodentate and bidentate-bridged coordination modes and a monodeprotonated diethanolamine molecule. Both copper atoms are invol...
Autores principales: | , , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2020
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7472753/ https://www.ncbi.nlm.nih.gov/pubmed/32939308 http://dx.doi.org/10.1107/S2056989020011184 |
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author | Vynohradov, Oleksandr S. Pavlenko, Vadim A. Safyanova, Inna S. Znovjyak, Kateryna Shova, Sergiu Safarmamadov, Safarmamad M. |
author_facet | Vynohradov, Oleksandr S. Pavlenko, Vadim A. Safyanova, Inna S. Znovjyak, Kateryna Shova, Sergiu Safarmamadov, Safarmamad M. |
author_sort | Vynohradov, Oleksandr S. |
collection | PubMed |
description | The title compound, [Cu(2)(C(5)H(7)N(2))(C(4)H(10)NO(2))Cl(2)(C(5)H(8)N(2))], is a pyrazolate aminoalcohol complex which contains two dimethylpyrazole molecules in monodentate and bidentate-bridged coordination modes and a monodeprotonated diethanolamine molecule. Both copper atoms are involved in the formation of non-planar five-membered chelate rings. One Cu atom is in a distorted tetrahedral environment formed by the pyridine nitrogen atom of the protonated dimethylpyrazole molecule, the N atom of the deprotonated bridged dimethylpyrazole, the Cl atom and the bridged O atom of the monodeprotonated diethanolamine. The second Cu atom has an intermediate environment between trigonal bipyramidal and square pyramidal, formed by the N atom of the deprotonated bridged dimethylpyrazole, the Cl atom and the N atom of the aminoalcohol, and two O atoms of the deprotonated and protonated OH groups. In the crystal, N—H⋯Cl hydrogen bonds link the molecules into antisymmetric chains running along the a-axis direction. Adjacent chains are connected by O—H⋯O hydrogen bonds involving the hydroxyl group as donor. |
format | Online Article Text |
id | pubmed-7472753 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2020 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-74727532020-09-15 Crystal structure of dichlorido-1κCl,2κCl-(μ(2)-3,5-dimethyl-1H-pyrazolato-1κN (2):2κN (1))(3,5-dimethyl-1H-pyrazole-2κN (2)){μ-2-[(2-hydroxyethyl)amino-1κ(2) N,O]ethanolato-1:2κ(2) O:O}dicopper(II) Vynohradov, Oleksandr S. Pavlenko, Vadim A. Safyanova, Inna S. Znovjyak, Kateryna Shova, Sergiu Safarmamadov, Safarmamad M. Acta Crystallogr E Crystallogr Commun Research Communications The title compound, [Cu(2)(C(5)H(7)N(2))(C(4)H(10)NO(2))Cl(2)(C(5)H(8)N(2))], is a pyrazolate aminoalcohol complex which contains two dimethylpyrazole molecules in monodentate and bidentate-bridged coordination modes and a monodeprotonated diethanolamine molecule. Both copper atoms are involved in the formation of non-planar five-membered chelate rings. One Cu atom is in a distorted tetrahedral environment formed by the pyridine nitrogen atom of the protonated dimethylpyrazole molecule, the N atom of the deprotonated bridged dimethylpyrazole, the Cl atom and the bridged O atom of the monodeprotonated diethanolamine. The second Cu atom has an intermediate environment between trigonal bipyramidal and square pyramidal, formed by the N atom of the deprotonated bridged dimethylpyrazole, the Cl atom and the N atom of the aminoalcohol, and two O atoms of the deprotonated and protonated OH groups. In the crystal, N—H⋯Cl hydrogen bonds link the molecules into antisymmetric chains running along the a-axis direction. Adjacent chains are connected by O—H⋯O hydrogen bonds involving the hydroxyl group as donor. International Union of Crystallography 2020-08-25 /pmc/articles/PMC7472753/ /pubmed/32939308 http://dx.doi.org/10.1107/S2056989020011184 Text en © Vynohradov et al. 2020 http://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.http://creativecommons.org/licenses/by/4.0/ |
spellingShingle | Research Communications Vynohradov, Oleksandr S. Pavlenko, Vadim A. Safyanova, Inna S. Znovjyak, Kateryna Shova, Sergiu Safarmamadov, Safarmamad M. Crystal structure of dichlorido-1κCl,2κCl-(μ(2)-3,5-dimethyl-1H-pyrazolato-1κN (2):2κN (1))(3,5-dimethyl-1H-pyrazole-2κN (2)){μ-2-[(2-hydroxyethyl)amino-1κ(2) N,O]ethanolato-1:2κ(2) O:O}dicopper(II) |
title | Crystal structure of dichlorido-1κCl,2κCl-(μ(2)-3,5-dimethyl-1H-pyrazolato-1κN
(2):2κN
(1))(3,5-dimethyl-1H-pyrazole-2κN
(2)){μ-2-[(2-hydroxyethyl)amino-1κ(2)
N,O]ethanolato-1:2κ(2)
O:O}dicopper(II) |
title_full | Crystal structure of dichlorido-1κCl,2κCl-(μ(2)-3,5-dimethyl-1H-pyrazolato-1κN
(2):2κN
(1))(3,5-dimethyl-1H-pyrazole-2κN
(2)){μ-2-[(2-hydroxyethyl)amino-1κ(2)
N,O]ethanolato-1:2κ(2)
O:O}dicopper(II) |
title_fullStr | Crystal structure of dichlorido-1κCl,2κCl-(μ(2)-3,5-dimethyl-1H-pyrazolato-1κN
(2):2κN
(1))(3,5-dimethyl-1H-pyrazole-2κN
(2)){μ-2-[(2-hydroxyethyl)amino-1κ(2)
N,O]ethanolato-1:2κ(2)
O:O}dicopper(II) |
title_full_unstemmed | Crystal structure of dichlorido-1κCl,2κCl-(μ(2)-3,5-dimethyl-1H-pyrazolato-1κN
(2):2κN
(1))(3,5-dimethyl-1H-pyrazole-2κN
(2)){μ-2-[(2-hydroxyethyl)amino-1κ(2)
N,O]ethanolato-1:2κ(2)
O:O}dicopper(II) |
title_short | Crystal structure of dichlorido-1κCl,2κCl-(μ(2)-3,5-dimethyl-1H-pyrazolato-1κN
(2):2κN
(1))(3,5-dimethyl-1H-pyrazole-2κN
(2)){μ-2-[(2-hydroxyethyl)amino-1κ(2)
N,O]ethanolato-1:2κ(2)
O:O}dicopper(II) |
title_sort | crystal structure of dichlorido-1κcl,2κcl-(μ(2)-3,5-dimethyl-1h-pyrazolato-1κn
(2):2κn
(1))(3,5-dimethyl-1h-pyrazole-2κn
(2)){μ-2-[(2-hydroxyethyl)amino-1κ(2)
n,o]ethanolato-1:2κ(2)
o:o}dicopper(ii) |
topic | Research Communications |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7472753/ https://www.ncbi.nlm.nih.gov/pubmed/32939308 http://dx.doi.org/10.1107/S2056989020011184 |
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