Cargando…
Crystal structure and Hirshfeld surfaces analysis of the nickel(II) complex of the Shiff base ligand 6,6′-{(1E,1′E)-[ethane-1,2-diylbis(azanylylidene)]bis(methanylylidene)}bis[2-(trifluoromethoxy)phenol]
In the title complex, (6,6′-{(1E,1′E)-[ethane-1,2-diylbis(azanylylidene)]bis(methanylylidene)}bis[2-(trifluoromethoxy)phenol]-κ(4) O,N,N′,O′)nickel(II), [Ni(C(18)H(12)F(6)N(2)O(4))], the nickel(II) ion has a square-planar coordination sphere, being ligated by two N and two O atoms of the Schi...
Autores principales: | , , , , |
---|---|
Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2019
|
Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6399694/ https://www.ncbi.nlm.nih.gov/pubmed/30867942 http://dx.doi.org/10.1107/S2056989019001919 |
_version_ | 1783399799220862976 |
---|---|
author | Demir Kanmazalp, Sibel Meral, Seher Dege, Necmi Alaman Agar, Aysen Fritsky, Igor O. |
author_facet | Demir Kanmazalp, Sibel Meral, Seher Dege, Necmi Alaman Agar, Aysen Fritsky, Igor O. |
author_sort | Demir Kanmazalp, Sibel |
collection | PubMed |
description | In the title complex, (6,6′-{(1E,1′E)-[ethane-1,2-diylbis(azanylylidene)]bis(methanylylidene)}bis[2-(trifluoromethoxy)phenol]-κ(4) O,N,N′,O′)nickel(II), [Ni(C(18)H(12)F(6)N(2)O(4))], the nickel(II) ion has a square-planar coordination sphere, being ligated by two N and two O atoms of the Schiff base ligand 6,6′-{(1E,1′E)-[ethane-1,2-diylbis(azanylylidene)]bis(methanylylidene)}bis[2-(trifluoromethoxy)phenol] (L). Inversion-related molecules are linked by a short Ni⋯Ni interaction of 3.2945 (6) Å forming a dimer. In the crystal, the dimers stack up the a axis, with a closest Ni⋯Ni separation of ca 3.791 Å. There are no other significant intermolecular interactions present. However, the Hirshfeld surface analysis and the two-dimensional fingerprint plots indicate that the packing is dominated by H⋯F/F⋯H, H⋯H, O⋯H/H⋯O and C⋯H/H⋯C contacts. |
format | Online Article Text |
id | pubmed-6399694 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2019 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-63996942019-03-13 Crystal structure and Hirshfeld surfaces analysis of the nickel(II) complex of the Shiff base ligand 6,6′-{(1E,1′E)-[ethane-1,2-diylbis(azanylylidene)]bis(methanylylidene)}bis[2-(trifluoromethoxy)phenol] Demir Kanmazalp, Sibel Meral, Seher Dege, Necmi Alaman Agar, Aysen Fritsky, Igor O. Acta Crystallogr E Crystallogr Commun Research Communications In the title complex, (6,6′-{(1E,1′E)-[ethane-1,2-diylbis(azanylylidene)]bis(methanylylidene)}bis[2-(trifluoromethoxy)phenol]-κ(4) O,N,N′,O′)nickel(II), [Ni(C(18)H(12)F(6)N(2)O(4))], the nickel(II) ion has a square-planar coordination sphere, being ligated by two N and two O atoms of the Schiff base ligand 6,6′-{(1E,1′E)-[ethane-1,2-diylbis(azanylylidene)]bis(methanylylidene)}bis[2-(trifluoromethoxy)phenol] (L). Inversion-related molecules are linked by a short Ni⋯Ni interaction of 3.2945 (6) Å forming a dimer. In the crystal, the dimers stack up the a axis, with a closest Ni⋯Ni separation of ca 3.791 Å. There are no other significant intermolecular interactions present. However, the Hirshfeld surface analysis and the two-dimensional fingerprint plots indicate that the packing is dominated by H⋯F/F⋯H, H⋯H, O⋯H/H⋯O and C⋯H/H⋯C contacts. International Union of Crystallography 2019-02-08 /pmc/articles/PMC6399694/ /pubmed/30867942 http://dx.doi.org/10.1107/S2056989019001919 Text en © Demir Kanmazalp 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 Demir Kanmazalp, Sibel Meral, Seher Dege, Necmi Alaman Agar, Aysen Fritsky, Igor O. Crystal structure and Hirshfeld surfaces analysis of the nickel(II) complex of the Shiff base ligand 6,6′-{(1E,1′E)-[ethane-1,2-diylbis(azanylylidene)]bis(methanylylidene)}bis[2-(trifluoromethoxy)phenol] |
title | Crystal structure and Hirshfeld surfaces analysis of the nickel(II) complex of the Shiff base ligand 6,6′-{(1E,1′E)-[ethane-1,2-diylbis(azanylylidene)]bis(methanylylidene)}bis[2-(trifluoromethoxy)phenol] |
title_full | Crystal structure and Hirshfeld surfaces analysis of the nickel(II) complex of the Shiff base ligand 6,6′-{(1E,1′E)-[ethane-1,2-diylbis(azanylylidene)]bis(methanylylidene)}bis[2-(trifluoromethoxy)phenol] |
title_fullStr | Crystal structure and Hirshfeld surfaces analysis of the nickel(II) complex of the Shiff base ligand 6,6′-{(1E,1′E)-[ethane-1,2-diylbis(azanylylidene)]bis(methanylylidene)}bis[2-(trifluoromethoxy)phenol] |
title_full_unstemmed | Crystal structure and Hirshfeld surfaces analysis of the nickel(II) complex of the Shiff base ligand 6,6′-{(1E,1′E)-[ethane-1,2-diylbis(azanylylidene)]bis(methanylylidene)}bis[2-(trifluoromethoxy)phenol] |
title_short | Crystal structure and Hirshfeld surfaces analysis of the nickel(II) complex of the Shiff base ligand 6,6′-{(1E,1′E)-[ethane-1,2-diylbis(azanylylidene)]bis(methanylylidene)}bis[2-(trifluoromethoxy)phenol] |
title_sort | crystal structure and hirshfeld surfaces analysis of the nickel(ii) complex of the shiff base ligand 6,6′-{(1e,1′e)-[ethane-1,2-diylbis(azanylylidene)]bis(methanylylidene)}bis[2-(trifluoromethoxy)phenol] |
topic | Research Communications |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6399694/ https://www.ncbi.nlm.nih.gov/pubmed/30867942 http://dx.doi.org/10.1107/S2056989019001919 |
work_keys_str_mv | AT demirkanmazalpsibel crystalstructureandhirshfeldsurfacesanalysisofthenickeliicomplexoftheshiffbaseligand661e1eethane12diylbisazanylylidenebismethanylylidenebis2trifluoromethoxyphenol AT meralseher crystalstructureandhirshfeldsurfacesanalysisofthenickeliicomplexoftheshiffbaseligand661e1eethane12diylbisazanylylidenebismethanylylidenebis2trifluoromethoxyphenol AT degenecmi crystalstructureandhirshfeldsurfacesanalysisofthenickeliicomplexoftheshiffbaseligand661e1eethane12diylbisazanylylidenebismethanylylidenebis2trifluoromethoxyphenol AT alamanagaraysen crystalstructureandhirshfeldsurfacesanalysisofthenickeliicomplexoftheshiffbaseligand661e1eethane12diylbisazanylylidenebismethanylylidenebis2trifluoromethoxyphenol AT fritskyigoro crystalstructureandhirshfeldsurfacesanalysisofthenickeliicomplexoftheshiffbaseligand661e1eethane12diylbisazanylylidenebismethanylylidenebis2trifluoromethoxyphenol |