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Iodido{4-phenyl-1-[1-(1,3-thia­zol-2-yl-κN)ethyl­idene]thio­semicarbazidato-κ(2) N′,S}{4-phenyl-1-[1-(1,3-thia­zol-2-yl)ethyl­idene]thio­semicarbazide-κS}cadmium(II)

In the title complex, [Cd(C(12)H(11)N(4)S(2))I(C(12)H(12)N(4)S(2))], the Cd(II) ion is penta­coordinated by two thio­semicarbazone ligands (one neutral and the other anionic) and one iodide ion in a distorted square pyramidal (τ = 0.35) geometry. The central ion is coordinated by the thia­zole N ato...

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Autores principales: Venkatraman, Ramaiyer, Samuel, Dasary S., Arslan, Zikri, Hossain, Md. Alamgir, Fronczek, Frank R.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2013
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3647796/
https://www.ncbi.nlm.nih.gov/pubmed/23723762
http://dx.doi.org/10.1107/S160053681300915X
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author Venkatraman, Ramaiyer
Samuel, Dasary S.
Arslan, Zikri
Hossain, Md. Alamgir
Fronczek, Frank R.
author_facet Venkatraman, Ramaiyer
Samuel, Dasary S.
Arslan, Zikri
Hossain, Md. Alamgir
Fronczek, Frank R.
author_sort Venkatraman, Ramaiyer
collection PubMed
description In the title complex, [Cd(C(12)H(11)N(4)S(2))I(C(12)H(12)N(4)S(2))], the Cd(II) ion is penta­coordinated by two thio­semicarbazone ligands (one neutral and the other anionic) and one iodide ion in a distorted square pyramidal (τ = 0.35) geometry. The central ion is coordinated by the thia­zole N atom, the thio­ureido N and the S atom of the deprotonated thio­semicarbazone ligand. The other ligand is linked with the central ion through the C=S group. The deprotonated ligand intra­molecularly hydrogen bonds to the thia­zole ring N atom, while the ligand forms an inter­molecular hydrogen bond to the thiol­ate S atom of the second ligand. The deprotonation of the tridentate ligand and its coordination to the Cd(II) ion via the S atom strikingly affects the C—S bond lengths. The C—S bond lengths in the neutral and deprotonated ligands in the metal complex are 1.709 (3) and 1.748 (2) Å, respectively, whereas it is 1.671 (3) Å in the free ligand. In the metal complex, the Cd—S distances are 2.6449 (6) and 2.5510 (6) Å. The Cd—I bond length is 2.7860 (2) Å.
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spelling pubmed-36477962013-05-30 Iodido{4-phenyl-1-[1-(1,3-thia­zol-2-yl-κN)ethyl­idene]thio­semicarbazidato-κ(2) N′,S}{4-phenyl-1-[1-(1,3-thia­zol-2-yl)ethyl­idene]thio­semicarbazide-κS}cadmium(II) Venkatraman, Ramaiyer Samuel, Dasary S. Arslan, Zikri Hossain, Md. Alamgir Fronczek, Frank R. Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers In the title complex, [Cd(C(12)H(11)N(4)S(2))I(C(12)H(12)N(4)S(2))], the Cd(II) ion is penta­coordinated by two thio­semicarbazone ligands (one neutral and the other anionic) and one iodide ion in a distorted square pyramidal (τ = 0.35) geometry. The central ion is coordinated by the thia­zole N atom, the thio­ureido N and the S atom of the deprotonated thio­semicarbazone ligand. The other ligand is linked with the central ion through the C=S group. The deprotonated ligand intra­molecularly hydrogen bonds to the thia­zole ring N atom, while the ligand forms an inter­molecular hydrogen bond to the thiol­ate S atom of the second ligand. The deprotonation of the tridentate ligand and its coordination to the Cd(II) ion via the S atom strikingly affects the C—S bond lengths. The C—S bond lengths in the neutral and deprotonated ligands in the metal complex are 1.709 (3) and 1.748 (2) Å, respectively, whereas it is 1.671 (3) Å in the free ligand. In the metal complex, the Cd—S distances are 2.6449 (6) and 2.5510 (6) Å. The Cd—I bond length is 2.7860 (2) Å. International Union of Crystallography 2013-04-10 /pmc/articles/PMC3647796/ /pubmed/23723762 http://dx.doi.org/10.1107/S160053681300915X Text en © Venkatraman 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
Venkatraman, Ramaiyer
Samuel, Dasary S.
Arslan, Zikri
Hossain, Md. Alamgir
Fronczek, Frank R.
Iodido{4-phenyl-1-[1-(1,3-thia­zol-2-yl-κN)ethyl­idene]thio­semicarbazidato-κ(2) N′,S}{4-phenyl-1-[1-(1,3-thia­zol-2-yl)ethyl­idene]thio­semicarbazide-κS}cadmium(II)
title Iodido{4-phenyl-1-[1-(1,3-thia­zol-2-yl-κN)ethyl­idene]thio­semicarbazidato-κ(2) N′,S}{4-phenyl-1-[1-(1,3-thia­zol-2-yl)ethyl­idene]thio­semicarbazide-κS}cadmium(II)
title_full Iodido{4-phenyl-1-[1-(1,3-thia­zol-2-yl-κN)ethyl­idene]thio­semicarbazidato-κ(2) N′,S}{4-phenyl-1-[1-(1,3-thia­zol-2-yl)ethyl­idene]thio­semicarbazide-κS}cadmium(II)
title_fullStr Iodido{4-phenyl-1-[1-(1,3-thia­zol-2-yl-κN)ethyl­idene]thio­semicarbazidato-κ(2) N′,S}{4-phenyl-1-[1-(1,3-thia­zol-2-yl)ethyl­idene]thio­semicarbazide-κS}cadmium(II)
title_full_unstemmed Iodido{4-phenyl-1-[1-(1,3-thia­zol-2-yl-κN)ethyl­idene]thio­semicarbazidato-κ(2) N′,S}{4-phenyl-1-[1-(1,3-thia­zol-2-yl)ethyl­idene]thio­semicarbazide-κS}cadmium(II)
title_short Iodido{4-phenyl-1-[1-(1,3-thia­zol-2-yl-κN)ethyl­idene]thio­semicarbazidato-κ(2) N′,S}{4-phenyl-1-[1-(1,3-thia­zol-2-yl)ethyl­idene]thio­semicarbazide-κS}cadmium(II)
title_sort iodido{4-phenyl-1-[1-(1,3-thia­zol-2-yl-κn)ethyl­idene]thio­semicarbazidato-κ(2) n′,s}{4-phenyl-1-[1-(1,3-thia­zol-2-yl)ethyl­idene]thio­semicarbazide-κs}cadmium(ii)
topic Metal-Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3647796/
https://www.ncbi.nlm.nih.gov/pubmed/23723762
http://dx.doi.org/10.1107/S160053681300915X
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