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Synthesis, structure and Hirshfeld surface analysis of a coordination compound of cadmium acetate with 2-amino­benzoxazole

A first coordination compound of 2-amino­benzoxazole (2AB), namely, bis­(2-amino­benzoxazole-κN (3))bis­(acetato-κ(2) O,O′)cadmium(II), [Cd(CH(3)COO)(2)(2AB)(2)], has been synthesized from ethanol solutions of Cd(CH(3)(COO)(2) and 2AB. In the monoclinic crystals with the space group C2(1)/c, the cad...

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Autores principales: Razzoqova, Surayyo, Ibragimov, Aziz, Torambetov, Batirbay, Kadirova, Shakhnoza, Holczbauer, Tamas, Ashurov, Jamshid, Ibragimov, Bakhtiyar
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10483566/
https://www.ncbi.nlm.nih.gov/pubmed/37693679
http://dx.doi.org/10.1107/S2056989023007399
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author Razzoqova, Surayyo
Ibragimov, Aziz
Torambetov, Batirbay
Kadirova, Shakhnoza
Holczbauer, Tamas
Ashurov, Jamshid
Ibragimov, Bakhtiyar
author_facet Razzoqova, Surayyo
Ibragimov, Aziz
Torambetov, Batirbay
Kadirova, Shakhnoza
Holczbauer, Tamas
Ashurov, Jamshid
Ibragimov, Bakhtiyar
author_sort Razzoqova, Surayyo
collection PubMed
description A first coordination compound of 2-amino­benzoxazole (2AB), namely, bis­(2-amino­benzoxazole-κN (3))bis­(acetato-κ(2) O,O′)cadmium(II), [Cd(CH(3)COO)(2)(2AB)(2)], has been synthesized from ethanol solutions of Cd(CH(3)(COO)(2) and 2AB. In the monoclinic crystals with the space group C2(1)/c, the cadmium ions coordinate two neutral 2AB mol­ecules in a monodentate fashion through the oxazole N atom, while two acetate ligands are coordinated through the O atoms in a bidentate manner. The coordination polyhedron of the central ion is substanti­ally distorted octa­hedral. There are two relatively strong intra­molecular hydrogen bonds in the complex mol­ecule. Additionally, two inter­molecular hydrogen bonds associate complex mol­ecules into columns running in the [1 [Image: see text] 0] and [110] directions. The Hirshfeld surface analysis shows that 45.7% of the inter­molecular inter­actions are from H⋯H contacts, 24.7% are from O⋯H/H⋯O contacts and 18.8% are from C⋯H/H⋯C contacts, while other contributions are from N⋯H/H⋯N and O⋯O contacts.
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spelling pubmed-104835662023-09-08 Synthesis, structure and Hirshfeld surface analysis of a coordination compound of cadmium acetate with 2-amino­benzoxazole Razzoqova, Surayyo Ibragimov, Aziz Torambetov, Batirbay Kadirova, Shakhnoza Holczbauer, Tamas Ashurov, Jamshid Ibragimov, Bakhtiyar Acta Crystallogr E Crystallogr Commun Research Communications A first coordination compound of 2-amino­benzoxazole (2AB), namely, bis­(2-amino­benzoxazole-κN (3))bis­(acetato-κ(2) O,O′)cadmium(II), [Cd(CH(3)COO)(2)(2AB)(2)], has been synthesized from ethanol solutions of Cd(CH(3)(COO)(2) and 2AB. In the monoclinic crystals with the space group C2(1)/c, the cadmium ions coordinate two neutral 2AB mol­ecules in a monodentate fashion through the oxazole N atom, while two acetate ligands are coordinated through the O atoms in a bidentate manner. The coordination polyhedron of the central ion is substanti­ally distorted octa­hedral. There are two relatively strong intra­molecular hydrogen bonds in the complex mol­ecule. Additionally, two inter­molecular hydrogen bonds associate complex mol­ecules into columns running in the [1 [Image: see text] 0] and [110] directions. The Hirshfeld surface analysis shows that 45.7% of the inter­molecular inter­actions are from H⋯H contacts, 24.7% are from O⋯H/H⋯O contacts and 18.8% are from C⋯H/H⋯C contacts, while other contributions are from N⋯H/H⋯N and O⋯O contacts. International Union of Crystallography 2023-08-30 /pmc/articles/PMC10483566/ /pubmed/37693679 http://dx.doi.org/10.1107/S2056989023007399 Text en © Razzoqova et al. 2023 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
Razzoqova, Surayyo
Ibragimov, Aziz
Torambetov, Batirbay
Kadirova, Shakhnoza
Holczbauer, Tamas
Ashurov, Jamshid
Ibragimov, Bakhtiyar
Synthesis, structure and Hirshfeld surface analysis of a coordination compound of cadmium acetate with 2-amino­benzoxazole
title Synthesis, structure and Hirshfeld surface analysis of a coordination compound of cadmium acetate with 2-amino­benzoxazole
title_full Synthesis, structure and Hirshfeld surface analysis of a coordination compound of cadmium acetate with 2-amino­benzoxazole
title_fullStr Synthesis, structure and Hirshfeld surface analysis of a coordination compound of cadmium acetate with 2-amino­benzoxazole
title_full_unstemmed Synthesis, structure and Hirshfeld surface analysis of a coordination compound of cadmium acetate with 2-amino­benzoxazole
title_short Synthesis, structure and Hirshfeld surface analysis of a coordination compound of cadmium acetate with 2-amino­benzoxazole
title_sort synthesis, structure and hirshfeld surface analysis of a coordination compound of cadmium acetate with 2-amino­benzoxazole
topic Research Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10483566/
https://www.ncbi.nlm.nih.gov/pubmed/37693679
http://dx.doi.org/10.1107/S2056989023007399
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