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Crystal structure of di­aqua­tris­(benzohydrazide-κ(2) N,O)(isophthalato-κO)samarium(III) nitrate

The first benzohydrazide complex of a lanthanide is reported. In the title compound, [Sm(C(8)H(4)O(4))(C(7)H(8)N(2)O)(3)(H(2)O)(2)]NO(3), systematic name di­aqua­tris­(benzohydrazide-κ(2) N,O)(isophthalato-κO)samarium(III) nitrate, the Sm(III) ion is nine-coordinated in a distorted tricapped trigona...

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Detalles Bibliográficos
Autores principales: Theppitak, Chatphorn, Kielar, Filip, Chainok, Kittipong
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2018
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6281109/
https://www.ncbi.nlm.nih.gov/pubmed/30574357
http://dx.doi.org/10.1107/S2056989018015360
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author Theppitak, Chatphorn
Kielar, Filip
Chainok, Kittipong
author_facet Theppitak, Chatphorn
Kielar, Filip
Chainok, Kittipong
author_sort Theppitak, Chatphorn
collection PubMed
description The first benzohydrazide complex of a lanthanide is reported. In the title compound, [Sm(C(8)H(4)O(4))(C(7)H(8)N(2)O)(3)(H(2)O)(2)]NO(3), systematic name di­aqua­tris­(benzohydrazide-κ(2) N,O)(isophthalato-κO)samarium(III) nitrate, the Sm(III) ion is nine-coordinated in a distorted tricapped trigonal–prismatic geometry by three oxygen atoms and three nitro­gen atoms from three benzhydrazide (bzz) ligands, one oxygen atom from the isophthalate (itp(2−)) ligand, and two oxygen atoms from coordinated water mol­ecules. The nitrate group is disordered over two sets of sites with occupancy factors of 0.310 (17) and 0.690 (17). In the crystal, adjacent mol­ecules are linked into chains via pairs of O—H⋯O and N—H⋯O hydrogen bonds between the carboxyl­ate acceptor and the coordinated water and amine NH(2) donors. Mol­ecules are further stacked by π–π inter­actions involving the benzene ring of the itp(2−) ligands, forming double chains that extend in the b-axis direction. These double chains are further linked into a three-dimensional supra­molecular network via hydrogen bonds (O—H⋯O, N—H⋯O and C—H⋯O) between the complex mol­ecule and the nitrate groups along with C—H⋯π and π–π inter­actions involving the benzene rings of the bzz and itp(2−) ligands.
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spelling pubmed-62811092018-12-20 Crystal structure of di­aqua­tris­(benzohydrazide-κ(2) N,O)(isophthalato-κO)samarium(III) nitrate Theppitak, Chatphorn Kielar, Filip Chainok, Kittipong Acta Crystallogr E Crystallogr Commun Research Communications The first benzohydrazide complex of a lanthanide is reported. In the title compound, [Sm(C(8)H(4)O(4))(C(7)H(8)N(2)O)(3)(H(2)O)(2)]NO(3), systematic name di­aqua­tris­(benzohydrazide-κ(2) N,O)(isophthalato-κO)samarium(III) nitrate, the Sm(III) ion is nine-coordinated in a distorted tricapped trigonal–prismatic geometry by three oxygen atoms and three nitro­gen atoms from three benzhydrazide (bzz) ligands, one oxygen atom from the isophthalate (itp(2−)) ligand, and two oxygen atoms from coordinated water mol­ecules. The nitrate group is disordered over two sets of sites with occupancy factors of 0.310 (17) and 0.690 (17). In the crystal, adjacent mol­ecules are linked into chains via pairs of O—H⋯O and N—H⋯O hydrogen bonds between the carboxyl­ate acceptor and the coordinated water and amine NH(2) donors. Mol­ecules are further stacked by π–π inter­actions involving the benzene ring of the itp(2−) ligands, forming double chains that extend in the b-axis direction. These double chains are further linked into a three-dimensional supra­molecular network via hydrogen bonds (O—H⋯O, N—H⋯O and C—H⋯O) between the complex mol­ecule and the nitrate groups along with C—H⋯π and π–π inter­actions involving the benzene rings of the bzz and itp(2−) ligands. International Union of Crystallography 2018-11-06 /pmc/articles/PMC6281109/ /pubmed/30574357 http://dx.doi.org/10.1107/S2056989018015360 Text en © Theppitak 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 Communications
Theppitak, Chatphorn
Kielar, Filip
Chainok, Kittipong
Crystal structure of di­aqua­tris­(benzohydrazide-κ(2) N,O)(isophthalato-κO)samarium(III) nitrate
title Crystal structure of di­aqua­tris­(benzohydrazide-κ(2) N,O)(isophthalato-κO)samarium(III) nitrate
title_full Crystal structure of di­aqua­tris­(benzohydrazide-κ(2) N,O)(isophthalato-κO)samarium(III) nitrate
title_fullStr Crystal structure of di­aqua­tris­(benzohydrazide-κ(2) N,O)(isophthalato-κO)samarium(III) nitrate
title_full_unstemmed Crystal structure of di­aqua­tris­(benzohydrazide-κ(2) N,O)(isophthalato-κO)samarium(III) nitrate
title_short Crystal structure of di­aqua­tris­(benzohydrazide-κ(2) N,O)(isophthalato-κO)samarium(III) nitrate
title_sort crystal structure of di­aqua­tris­(benzohydrazide-κ(2) n,o)(isophthalato-κo)samarium(iii) nitrate
topic Research Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6281109/
https://www.ncbi.nlm.nih.gov/pubmed/30574357
http://dx.doi.org/10.1107/S2056989018015360
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