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N,N,N,N′,N′,N′-Hexa­kis­(2-hy­droxy­ethyl)butane-1,4-diaminium bis­(2-sul­fan­ylidene-1,3-di­thiole-4,5-dithiolato-κ(2) S (4),S (5))zincate

In the asymmetric unit of the title compound, (C(16)H(38)N(2)O(6))[Zn(C(3)S(5))(2)], two independent cations lie across inversion centers. In one of the cations, the three symmetry-unique O—H groups are disordered over two sets of sites with refined occupancy ratios of 0.701 (9):0.299 (9), 0.671 (8)...

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Detalles Bibliográficos
Autores principales: Zhang, Xiulan, Xie, Bin, Zou, Like, Wang, Jun, Lin, Xiao
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2013
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3772409/
https://www.ncbi.nlm.nih.gov/pubmed/24046552
http://dx.doi.org/10.1107/S1600536813014992
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author Zhang, Xiulan
Xie, Bin
Zou, Like
Wang, Jun
Lin, Xiao
author_facet Zhang, Xiulan
Xie, Bin
Zou, Like
Wang, Jun
Lin, Xiao
author_sort Zhang, Xiulan
collection PubMed
description In the asymmetric unit of the title compound, (C(16)H(38)N(2)O(6))[Zn(C(3)S(5))(2)], two independent cations lie across inversion centers. In one of the cations, the three symmetry-unique O—H groups are disordered over two sets of sites with refined occupancy ratios of 0.701 (9):0.299 (9), 0.671 (8):0.329 (8) and 0.566 (7):0.434 (7). In the anion, the Zn(II) ion is coordinated in a distorted tetra­hedral environment by four S atoms of two chelating 1,3-di­thiole-2-thione-4,5-dithiolato ligands. The dihedral angle between the mean planes [maximun deviations = 0.022 (3) and 0.0656 (6) Å] of the two ligands is 87.76 (3)°. An intamolecular O—H⋯O hydrogen bond occurs in the disordered cation. In the crystal, O—H⋯O and O—H⋯S hydrogen bonds link the components into a two-dimensional network parallel to (0-11).
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spelling pubmed-37724092013-09-17 N,N,N,N′,N′,N′-Hexa­kis­(2-hy­droxy­ethyl)butane-1,4-diaminium bis­(2-sul­fan­ylidene-1,3-di­thiole-4,5-dithiolato-κ(2) S (4),S (5))zincate Zhang, Xiulan Xie, Bin Zou, Like Wang, Jun Lin, Xiao Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers In the asymmetric unit of the title compound, (C(16)H(38)N(2)O(6))[Zn(C(3)S(5))(2)], two independent cations lie across inversion centers. In one of the cations, the three symmetry-unique O—H groups are disordered over two sets of sites with refined occupancy ratios of 0.701 (9):0.299 (9), 0.671 (8):0.329 (8) and 0.566 (7):0.434 (7). In the anion, the Zn(II) ion is coordinated in a distorted tetra­hedral environment by four S atoms of two chelating 1,3-di­thiole-2-thione-4,5-dithiolato ligands. The dihedral angle between the mean planes [maximun deviations = 0.022 (3) and 0.0656 (6) Å] of the two ligands is 87.76 (3)°. An intamolecular O—H⋯O hydrogen bond occurs in the disordered cation. In the crystal, O—H⋯O and O—H⋯S hydrogen bonds link the components into a two-dimensional network parallel to (0-11). International Union of Crystallography 2013-06-08 /pmc/articles/PMC3772409/ /pubmed/24046552 http://dx.doi.org/10.1107/S1600536813014992 Text en © Zhang et al. 2013 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.
spellingShingle Metal-Organic Papers
Zhang, Xiulan
Xie, Bin
Zou, Like
Wang, Jun
Lin, Xiao
N,N,N,N′,N′,N′-Hexa­kis­(2-hy­droxy­ethyl)butane-1,4-diaminium bis­(2-sul­fan­ylidene-1,3-di­thiole-4,5-dithiolato-κ(2) S (4),S (5))zincate
title N,N,N,N′,N′,N′-Hexa­kis­(2-hy­droxy­ethyl)butane-1,4-diaminium bis­(2-sul­fan­ylidene-1,3-di­thiole-4,5-dithiolato-κ(2) S (4),S (5))zincate
title_full N,N,N,N′,N′,N′-Hexa­kis­(2-hy­droxy­ethyl)butane-1,4-diaminium bis­(2-sul­fan­ylidene-1,3-di­thiole-4,5-dithiolato-κ(2) S (4),S (5))zincate
title_fullStr N,N,N,N′,N′,N′-Hexa­kis­(2-hy­droxy­ethyl)butane-1,4-diaminium bis­(2-sul­fan­ylidene-1,3-di­thiole-4,5-dithiolato-κ(2) S (4),S (5))zincate
title_full_unstemmed N,N,N,N′,N′,N′-Hexa­kis­(2-hy­droxy­ethyl)butane-1,4-diaminium bis­(2-sul­fan­ylidene-1,3-di­thiole-4,5-dithiolato-κ(2) S (4),S (5))zincate
title_short N,N,N,N′,N′,N′-Hexa­kis­(2-hy­droxy­ethyl)butane-1,4-diaminium bis­(2-sul­fan­ylidene-1,3-di­thiole-4,5-dithiolato-κ(2) S (4),S (5))zincate
title_sort n,n,n,n′,n′,n′-hexa­kis­(2-hy­droxy­ethyl)butane-1,4-diaminium bis­(2-sul­fan­ylidene-1,3-di­thiole-4,5-dithiolato-κ(2) s (4),s (5))zincate
topic Metal-Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3772409/
https://www.ncbi.nlm.nih.gov/pubmed/24046552
http://dx.doi.org/10.1107/S1600536813014992
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