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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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Formato: | Online Artículo Texto |
Lenguaje: | English |
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International Union of Crystallography
2018
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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. |
format | Online Article Text |
id | pubmed-6281109 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2018 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
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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