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Crystal structure of trans-bis­[2-(1H-benzotriazol-1-yl)acetato-κO]bis­(ethano­lamine-κ(2) N,O)copper(II)

The reaction of 2-(1H-benzotriazol-1-yl)acetic acid (HBTA; C(8)H(7)N(3)O(2)) and mono­ethano­lamine (MEA; C(2)H(7)NO) with CuCl(2)·2H(2)O resulted in the formation of the title complex, [Cu(C(8)H(6)N(3)O(2))(2)(C(2)H(7)NO)(2)] or [Cu(BTA)(2)(MEA)(2)]. Its asymmetric unit comprises one BTA anion coor...

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Autores principales: Alieva, Guloy K., Ashurov, Jamshid M., Kadirova, Shahnoza A., Ibragimov, Bakhtiyar T., Zakhidov, Kasim A.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2019
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6362665/
https://www.ncbi.nlm.nih.gov/pubmed/30800457
http://dx.doi.org/10.1107/S2056989019000744
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author Alieva, Guloy K.
Ashurov, Jamshid M.
Kadirova, Shahnoza A.
Ibragimov, Bakhtiyar T.
Zakhidov, Kasim A.
author_facet Alieva, Guloy K.
Ashurov, Jamshid M.
Kadirova, Shahnoza A.
Ibragimov, Bakhtiyar T.
Zakhidov, Kasim A.
author_sort Alieva, Guloy K.
collection PubMed
description The reaction of 2-(1H-benzotriazol-1-yl)acetic acid (HBTA; C(8)H(7)N(3)O(2)) and mono­ethano­lamine (MEA; C(2)H(7)NO) with CuCl(2)·2H(2)O resulted in the formation of the title complex, [Cu(C(8)H(6)N(3)O(2))(2)(C(2)H(7)NO)(2)] or [Cu(BTA)(2)(MEA)(2)]. Its asymmetric unit comprises one BTA anion coordin­ating to the Cu(2+) cation (site symmetry [Image: see text]) through the carboxyl O atom, and one MEA ligand chelating the metal cation by two heteroatoms (O and N). The equatorial Cu—O and Cu—N bond lengths are similar at 2.029 (1) and 1.980 (2) Å, respectively, while the length of the axial Cu—O bond is considerably greater [2.492 (2) Å], as is typical for Jahn–Teller-distorted systems. An intra­molecular hydrogen bond is present between the hy­droxy group of the MEA ligand and the non-coordinating O atom of the carboxyl­ate group. Inter­molecular hydrogen bonding involving the amino function of the MEA ligand and the carboxyl­ate group results in eight-membered rings with an R (2) (2)(8) graph-set motif. The mol­ecules are further linked by C—H⋯π inter­actions involving the triazole rings and methyl­ene groups of MEA, thus generating an overall three-dimensional supra­molecular framework.
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spelling pubmed-63626652019-02-22 Crystal structure of trans-bis­[2-(1H-benzotriazol-1-yl)acetato-κO]bis­(ethano­lamine-κ(2) N,O)copper(II) Alieva, Guloy K. Ashurov, Jamshid M. Kadirova, Shahnoza A. Ibragimov, Bakhtiyar T. Zakhidov, Kasim A. Acta Crystallogr E Crystallogr Commun Research Communications The reaction of 2-(1H-benzotriazol-1-yl)acetic acid (HBTA; C(8)H(7)N(3)O(2)) and mono­ethano­lamine (MEA; C(2)H(7)NO) with CuCl(2)·2H(2)O resulted in the formation of the title complex, [Cu(C(8)H(6)N(3)O(2))(2)(C(2)H(7)NO)(2)] or [Cu(BTA)(2)(MEA)(2)]. Its asymmetric unit comprises one BTA anion coordin­ating to the Cu(2+) cation (site symmetry [Image: see text]) through the carboxyl O atom, and one MEA ligand chelating the metal cation by two heteroatoms (O and N). The equatorial Cu—O and Cu—N bond lengths are similar at 2.029 (1) and 1.980 (2) Å, respectively, while the length of the axial Cu—O bond is considerably greater [2.492 (2) Å], as is typical for Jahn–Teller-distorted systems. An intra­molecular hydrogen bond is present between the hy­droxy group of the MEA ligand and the non-coordinating O atom of the carboxyl­ate group. Inter­molecular hydrogen bonding involving the amino function of the MEA ligand and the carboxyl­ate group results in eight-membered rings with an R (2) (2)(8) graph-set motif. The mol­ecules are further linked by C—H⋯π inter­actions involving the triazole rings and methyl­ene groups of MEA, thus generating an overall three-dimensional supra­molecular framework. International Union of Crystallography 2019-01-18 /pmc/articles/PMC6362665/ /pubmed/30800457 http://dx.doi.org/10.1107/S2056989019000744 Text en © Alieva et al. 2019 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
Alieva, Guloy K.
Ashurov, Jamshid M.
Kadirova, Shahnoza A.
Ibragimov, Bakhtiyar T.
Zakhidov, Kasim A.
Crystal structure of trans-bis­[2-(1H-benzotriazol-1-yl)acetato-κO]bis­(ethano­lamine-κ(2) N,O)copper(II)
title Crystal structure of trans-bis­[2-(1H-benzotriazol-1-yl)acetato-κO]bis­(ethano­lamine-κ(2) N,O)copper(II)
title_full Crystal structure of trans-bis­[2-(1H-benzotriazol-1-yl)acetato-κO]bis­(ethano­lamine-κ(2) N,O)copper(II)
title_fullStr Crystal structure of trans-bis­[2-(1H-benzotriazol-1-yl)acetato-κO]bis­(ethano­lamine-κ(2) N,O)copper(II)
title_full_unstemmed Crystal structure of trans-bis­[2-(1H-benzotriazol-1-yl)acetato-κO]bis­(ethano­lamine-κ(2) N,O)copper(II)
title_short Crystal structure of trans-bis­[2-(1H-benzotriazol-1-yl)acetato-κO]bis­(ethano­lamine-κ(2) N,O)copper(II)
title_sort crystal structure of trans-bis­[2-(1h-benzotriazol-1-yl)acetato-κo]bis­(ethano­lamine-κ(2) n,o)copper(ii)
topic Research Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6362665/
https://www.ncbi.nlm.nih.gov/pubmed/30800457
http://dx.doi.org/10.1107/S2056989019000744
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