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Di-μ-cyanido-tetra­cyanido(5,5,7,12,12,14-hexa­methyl-1,4,8,11-tetra­aza­cyclo­tetra­decane)[N-(quinolin-8-yl)quinoline-2-carboxamidato]diiron(III)nickel(II) 2.07-hydrate

The asymmetric unit of the title complex, [Fe(2)Ni(C(19)H(12)N(3)O)(2)(CN)(6)(C(16)H(36)N(4))]·2.07H(2)O, contains one [Fe(qcq)(CN)(3)](−) anion, half a [Ni(teta)](2+) cation and two partially occupied inter­stitial water mol­ecules [qcq(−) is the N-(quinolin-8-yl)quinoline-2-carboxamidate anion and...

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Detalles Bibliográficos
Autores principales: Yang, Yuqi, Zhou, Hongbo, Shen, Xiaoping
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2013
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3647811/
https://www.ncbi.nlm.nih.gov/pubmed/23723777
http://dx.doi.org/10.1107/S1600536813010234
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author Yang, Yuqi
Zhou, Hongbo
Shen, Xiaoping
author_facet Yang, Yuqi
Zhou, Hongbo
Shen, Xiaoping
author_sort Yang, Yuqi
collection PubMed
description The asymmetric unit of the title complex, [Fe(2)Ni(C(19)H(12)N(3)O)(2)(CN)(6)(C(16)H(36)N(4))]·2.07H(2)O, contains one [Fe(qcq)(CN)(3)](−) anion, half a [Ni(teta)](2+) cation and two partially occupied inter­stitial water mol­ecules [qcq(−) is the N-(quinolin-8-yl)quinoline-2-carboxamidate anion and teta is 5,5,7,12,12,14-hexa­methyl-1,4,8,11-tetra­aza­cyclo­tetra­deca­ne]. In the complex mol­ecule, two [Fe(qcq)(CN)(3)](−) anions additionally coordinate the central [Ni(teta)](2+) cation through cyanide groups in a trans mode, resulting in a trinuclear structure with the Ni(2+) cation lying on an inversion centre. The two inter­stitial water mol­ecules are partially occupied, with occupancy factors of 0.528 (10) and 0.506 (9). O—H⋯O and O—H⋯N hydrogen bonding involving the two lattice water molecules and the carbonyl function and a teta N atom in an adjacent cluster leads to the formation of layers extending parallel to (010).
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spelling pubmed-36478112013-05-30 Di-μ-cyanido-tetra­cyanido(5,5,7,12,12,14-hexa­methyl-1,4,8,11-tetra­aza­cyclo­tetra­decane)[N-(quinolin-8-yl)quinoline-2-carboxamidato]diiron(III)nickel(II) 2.07-hydrate Yang, Yuqi Zhou, Hongbo Shen, Xiaoping Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers The asymmetric unit of the title complex, [Fe(2)Ni(C(19)H(12)N(3)O)(2)(CN)(6)(C(16)H(36)N(4))]·2.07H(2)O, contains one [Fe(qcq)(CN)(3)](−) anion, half a [Ni(teta)](2+) cation and two partially occupied inter­stitial water mol­ecules [qcq(−) is the N-(quinolin-8-yl)quinoline-2-carboxamidate anion and teta is 5,5,7,12,12,14-hexa­methyl-1,4,8,11-tetra­aza­cyclo­tetra­deca­ne]. In the complex mol­ecule, two [Fe(qcq)(CN)(3)](−) anions additionally coordinate the central [Ni(teta)](2+) cation through cyanide groups in a trans mode, resulting in a trinuclear structure with the Ni(2+) cation lying on an inversion centre. The two inter­stitial water mol­ecules are partially occupied, with occupancy factors of 0.528 (10) and 0.506 (9). O—H⋯O and O—H⋯N hydrogen bonding involving the two lattice water molecules and the carbonyl function and a teta N atom in an adjacent cluster leads to the formation of layers extending parallel to (010). International Union of Crystallography 2013-04-20 /pmc/articles/PMC3647811/ /pubmed/23723777 http://dx.doi.org/10.1107/S1600536813010234 Text en © Yang 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
Yang, Yuqi
Zhou, Hongbo
Shen, Xiaoping
Di-μ-cyanido-tetra­cyanido(5,5,7,12,12,14-hexa­methyl-1,4,8,11-tetra­aza­cyclo­tetra­decane)[N-(quinolin-8-yl)quinoline-2-carboxamidato]diiron(III)nickel(II) 2.07-hydrate
title Di-μ-cyanido-tetra­cyanido(5,5,7,12,12,14-hexa­methyl-1,4,8,11-tetra­aza­cyclo­tetra­decane)[N-(quinolin-8-yl)quinoline-2-carboxamidato]diiron(III)nickel(II) 2.07-hydrate
title_full Di-μ-cyanido-tetra­cyanido(5,5,7,12,12,14-hexa­methyl-1,4,8,11-tetra­aza­cyclo­tetra­decane)[N-(quinolin-8-yl)quinoline-2-carboxamidato]diiron(III)nickel(II) 2.07-hydrate
title_fullStr Di-μ-cyanido-tetra­cyanido(5,5,7,12,12,14-hexa­methyl-1,4,8,11-tetra­aza­cyclo­tetra­decane)[N-(quinolin-8-yl)quinoline-2-carboxamidato]diiron(III)nickel(II) 2.07-hydrate
title_full_unstemmed Di-μ-cyanido-tetra­cyanido(5,5,7,12,12,14-hexa­methyl-1,4,8,11-tetra­aza­cyclo­tetra­decane)[N-(quinolin-8-yl)quinoline-2-carboxamidato]diiron(III)nickel(II) 2.07-hydrate
title_short Di-μ-cyanido-tetra­cyanido(5,5,7,12,12,14-hexa­methyl-1,4,8,11-tetra­aza­cyclo­tetra­decane)[N-(quinolin-8-yl)quinoline-2-carboxamidato]diiron(III)nickel(II) 2.07-hydrate
title_sort di-μ-cyanido-tetra­cyanido(5,5,7,12,12,14-hexa­methyl-1,4,8,11-tetra­aza­cyclo­tetra­decane)[n-(quinolin-8-yl)quinoline-2-carboxamidato]diiron(iii)nickel(ii) 2.07-hydrate
topic Metal-Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3647811/
https://www.ncbi.nlm.nih.gov/pubmed/23723777
http://dx.doi.org/10.1107/S1600536813010234
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AT zhouhongbo dimcyanidotetracyanido557121214hexamethyl14811tetraazacyclotetradecanenquinolin8ylquinoline2carboxamidatodiironiiinickelii207hydrate
AT shenxiaoping dimcyanidotetracyanido557121214hexamethyl14811tetraazacyclotetradecanenquinolin8ylquinoline2carboxamidatodiironiiinickelii207hydrate