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Tetra­kis(tri­ethyl­enediamin-1-ium) dodeca-μ(2)-chlorido-hexakis(thio­cyanato-κN)hexa-octa­hedro-niobate

The crystal structure of the cluster complex salt, (C(6)H(13)N(2))(4)[Nb(6)(NCS)(6)Cl(12)] or (H-DABCO)(4)[Nb(6)Cl(12)(NCS)(6)] (DABCO = tri­ethyl­enedi­amine or 1,4-di­aza­bicyclo­[2.2.2]octa­ne), comprises octa­hedral Nb(6) cluster cores, which are μ(2)-coordinated by 12 chloride ligands (bridging...

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Detalles Bibliográficos
Autores principales: Sperlich, Eric, Köckerling, Martin
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10242733/
https://www.ncbi.nlm.nih.gov/pubmed/37287859
http://dx.doi.org/10.1107/S241431462300398X
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author Sperlich, Eric
Köckerling, Martin
author_facet Sperlich, Eric
Köckerling, Martin
author_sort Sperlich, Eric
collection PubMed
description The crystal structure of the cluster complex salt, (C(6)H(13)N(2))(4)[Nb(6)(NCS)(6)Cl(12)] or (H-DABCO)(4)[Nb(6)Cl(12)(NCS)(6)] (DABCO = tri­ethyl­enedi­amine or 1,4-di­aza­bicyclo­[2.2.2]octa­ne), comprises octa­hedral Nb(6) cluster cores, which are μ(2)-coordinated by 12 chloride ligands (bridging the octa­hedral edges, inner ligand sphere). Furthermore, each Nb atom is N-bonded to a terminal thio­cyanate ligand (outer ligand sphere). The discrete clusters carry a charge of −4, which is compensated by four monoprotonated DABCO mol­ecules. These are arranged in rows, which are N—H⋯Cl and N—H⋯N hydrogen bonded to the anions and among each other. [Image: see text]
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spelling pubmed-102427332023-06-07 Tetra­kis(tri­ethyl­enediamin-1-ium) dodeca-μ(2)-chlorido-hexakis(thio­cyanato-κN)hexa-octa­hedro-niobate Sperlich, Eric Köckerling, Martin IUCrdata Data Reports The crystal structure of the cluster complex salt, (C(6)H(13)N(2))(4)[Nb(6)(NCS)(6)Cl(12)] or (H-DABCO)(4)[Nb(6)Cl(12)(NCS)(6)] (DABCO = tri­ethyl­enedi­amine or 1,4-di­aza­bicyclo­[2.2.2]octa­ne), comprises octa­hedral Nb(6) cluster cores, which are μ(2)-coordinated by 12 chloride ligands (bridging the octa­hedral edges, inner ligand sphere). Furthermore, each Nb atom is N-bonded to a terminal thio­cyanate ligand (outer ligand sphere). The discrete clusters carry a charge of −4, which is compensated by four monoprotonated DABCO mol­ecules. These are arranged in rows, which are N—H⋯Cl and N—H⋯N hydrogen bonded to the anions and among each other. [Image: see text] International Union of Crystallography 2023-05-12 /pmc/articles/PMC10242733/ /pubmed/37287859 http://dx.doi.org/10.1107/S241431462300398X Text en © Sperlich and Köckerling 2023 https://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.
spellingShingle Data Reports
Sperlich, Eric
Köckerling, Martin
Tetra­kis(tri­ethyl­enediamin-1-ium) dodeca-μ(2)-chlorido-hexakis(thio­cyanato-κN)hexa-octa­hedro-niobate
title Tetra­kis(tri­ethyl­enediamin-1-ium) dodeca-μ(2)-chlorido-hexakis(thio­cyanato-κN)hexa-octa­hedro-niobate
title_full Tetra­kis(tri­ethyl­enediamin-1-ium) dodeca-μ(2)-chlorido-hexakis(thio­cyanato-κN)hexa-octa­hedro-niobate
title_fullStr Tetra­kis(tri­ethyl­enediamin-1-ium) dodeca-μ(2)-chlorido-hexakis(thio­cyanato-κN)hexa-octa­hedro-niobate
title_full_unstemmed Tetra­kis(tri­ethyl­enediamin-1-ium) dodeca-μ(2)-chlorido-hexakis(thio­cyanato-κN)hexa-octa­hedro-niobate
title_short Tetra­kis(tri­ethyl­enediamin-1-ium) dodeca-μ(2)-chlorido-hexakis(thio­cyanato-κN)hexa-octa­hedro-niobate
title_sort tetra­kis(tri­ethyl­enediamin-1-ium) dodeca-μ(2)-chlorido-hexakis(thio­cyanato-κn)hexa-octa­hedro-niobate
topic Data Reports
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10242733/
https://www.ncbi.nlm.nih.gov/pubmed/37287859
http://dx.doi.org/10.1107/S241431462300398X
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