Cargando…
Crystal structure of (4,4′-bipyridyl-κN)bis[N-(2-hydroxyethyl)-N-isopropyldithiocarbamato-κ(2) S,S′]zinc(II)–4,4′-bipyridyl (2/1) and its isostructural cadmium(II) analogue
The title structures, [M(C(6)H(12)NOS(2))(2)(C(10)H(8)N(2))]·0.5C(10)H(8)N(2), for M = Zn, (I), and Cd, (II), feature terminally bound 4,4′-bipyridyl ligands and non-coordinating 4,4′-bipyridyl molecules, with the latter disposed about a centre of inversion. The coordination geometry about the met...
Autores principales: | , |
---|---|
Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2017
|
Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5683481/ https://www.ncbi.nlm.nih.gov/pubmed/29152341 http://dx.doi.org/10.1107/S2056989017014396 |
_version_ | 1783278288828891136 |
---|---|
author | Tan, Yee Seng Tiekink, Edward R. T. |
author_facet | Tan, Yee Seng Tiekink, Edward R. T. |
author_sort | Tan, Yee Seng |
collection | PubMed |
description | The title structures, [M(C(6)H(12)NOS(2))(2)(C(10)H(8)N(2))]·0.5C(10)H(8)N(2), for M = Zn, (I), and Cd, (II), feature terminally bound 4,4′-bipyridyl ligands and non-coordinating 4,4′-bipyridyl molecules, with the latter disposed about a centre of inversion. The coordination geometry about the metal atom is defined by two non-symmetrically chelating dithiocarbamate ligands and a pyridyl N atom. The NS(4) donor sets are distorted but, approximate to trigonal bipyramidal in each case. In the crystal, hydroxy-O—H⋯O(hydroxy) and hydroxy-O—H⋯N(pyridyl) hydrogen bonds between the zinc-containing molecules lead to a supramolecular layer parallel to (100). The three-dimensional architecture arises as the layers are linked via methine-C—H⋯S, pyridyl-C—H⋯O(hydroxy) and π–π [inter-centroid distance between coordinated pyridyl rings = 3.6246 (18) Å] interactions. Channels along the c-axis direction are occupied by the non-coordinating 4,4′-bipyridine molecules, which are held in place by C—H⋯π(chelate ring) contacts. |
format | Online Article Text |
id | pubmed-5683481 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2017 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-56834812017-11-17 Crystal structure of (4,4′-bipyridyl-κN)bis[N-(2-hydroxyethyl)-N-isopropyldithiocarbamato-κ(2) S,S′]zinc(II)–4,4′-bipyridyl (2/1) and its isostructural cadmium(II) analogue Tan, Yee Seng Tiekink, Edward R. T. Acta Crystallogr E Crystallogr Commun Research Communications The title structures, [M(C(6)H(12)NOS(2))(2)(C(10)H(8)N(2))]·0.5C(10)H(8)N(2), for M = Zn, (I), and Cd, (II), feature terminally bound 4,4′-bipyridyl ligands and non-coordinating 4,4′-bipyridyl molecules, with the latter disposed about a centre of inversion. The coordination geometry about the metal atom is defined by two non-symmetrically chelating dithiocarbamate ligands and a pyridyl N atom. The NS(4) donor sets are distorted but, approximate to trigonal bipyramidal in each case. In the crystal, hydroxy-O—H⋯O(hydroxy) and hydroxy-O—H⋯N(pyridyl) hydrogen bonds between the zinc-containing molecules lead to a supramolecular layer parallel to (100). The three-dimensional architecture arises as the layers are linked via methine-C—H⋯S, pyridyl-C—H⋯O(hydroxy) and π–π [inter-centroid distance between coordinated pyridyl rings = 3.6246 (18) Å] interactions. Channels along the c-axis direction are occupied by the non-coordinating 4,4′-bipyridine molecules, which are held in place by C—H⋯π(chelate ring) contacts. International Union of Crystallography 2017-10-13 /pmc/articles/PMC5683481/ /pubmed/29152341 http://dx.doi.org/10.1107/S2056989017014396 Text en © Tan and Tiekink 2017 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 Tan, Yee Seng Tiekink, Edward R. T. Crystal structure of (4,4′-bipyridyl-κN)bis[N-(2-hydroxyethyl)-N-isopropyldithiocarbamato-κ(2) S,S′]zinc(II)–4,4′-bipyridyl (2/1) and its isostructural cadmium(II) analogue |
title | Crystal structure of (4,4′-bipyridyl-κN)bis[N-(2-hydroxyethyl)-N-isopropyldithiocarbamato-κ(2)
S,S′]zinc(II)–4,4′-bipyridyl (2/1) and its isostructural cadmium(II) analogue |
title_full | Crystal structure of (4,4′-bipyridyl-κN)bis[N-(2-hydroxyethyl)-N-isopropyldithiocarbamato-κ(2)
S,S′]zinc(II)–4,4′-bipyridyl (2/1) and its isostructural cadmium(II) analogue |
title_fullStr | Crystal structure of (4,4′-bipyridyl-κN)bis[N-(2-hydroxyethyl)-N-isopropyldithiocarbamato-κ(2)
S,S′]zinc(II)–4,4′-bipyridyl (2/1) and its isostructural cadmium(II) analogue |
title_full_unstemmed | Crystal structure of (4,4′-bipyridyl-κN)bis[N-(2-hydroxyethyl)-N-isopropyldithiocarbamato-κ(2)
S,S′]zinc(II)–4,4′-bipyridyl (2/1) and its isostructural cadmium(II) analogue |
title_short | Crystal structure of (4,4′-bipyridyl-κN)bis[N-(2-hydroxyethyl)-N-isopropyldithiocarbamato-κ(2)
S,S′]zinc(II)–4,4′-bipyridyl (2/1) and its isostructural cadmium(II) analogue |
title_sort | crystal structure of (4,4′-bipyridyl-κn)bis[n-(2-hydroxyethyl)-n-isopropyldithiocarbamato-κ(2)
s,s′]zinc(ii)–4,4′-bipyridyl (2/1) and its isostructural cadmium(ii) analogue |
topic | Research Communications |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5683481/ https://www.ncbi.nlm.nih.gov/pubmed/29152341 http://dx.doi.org/10.1107/S2056989017014396 |
work_keys_str_mv | AT tanyeeseng crystalstructureof44bipyridylknbisn2hydroxyethylnisopropyldithiocarbamatok2sszincii44bipyridyl21anditsisostructuralcadmiumiianalogue AT tiekinkedwardrt crystalstructureof44bipyridylknbisn2hydroxyethylnisopropyldithiocarbamatok2sszincii44bipyridyl21anditsisostructuralcadmiumiianalogue |