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Crystal structure of tris­(1,10-phenanthroline-κ(2) N,N′)iron(II) bis­[bis­(tri­fluoro­methyl­sulfon­yl)imide] monohydrate

The crystal structure of the title complex, [Fe(C(12)H(8)N(2))(3)][(CF(3)SO(2))(2)N](2)·H(2)O, is constructed by one octa­hedral [Fe(phen)(3)](2+) (phen = 1,10-phenanthroline) cation (point group symmetry 2), two Tf(2)N(−) [bis­(tri­fluoromethyl­sulfon­yl)imide] anions, and one water mol­ecule of cr...

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Detalles Bibliográficos
Autores principales: Teramoto, Kazunori, Kawasaki, Takeshi, Nishide, Toshikazu, Ikeda, Yasuhisa
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2015
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4331886/
https://www.ncbi.nlm.nih.gov/pubmed/25705476
http://dx.doi.org/10.1107/S2056989014026966
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author Teramoto, Kazunori
Kawasaki, Takeshi
Nishide, Toshikazu
Ikeda, Yasuhisa
author_facet Teramoto, Kazunori
Kawasaki, Takeshi
Nishide, Toshikazu
Ikeda, Yasuhisa
author_sort Teramoto, Kazunori
collection PubMed
description The crystal structure of the title complex, [Fe(C(12)H(8)N(2))(3)][(CF(3)SO(2))(2)N](2)·H(2)O, is constructed by one octa­hedral [Fe(phen)(3)](2+) (phen = 1,10-phenanthroline) cation (point group symmetry 2), two Tf(2)N(−) [bis­(tri­fluoromethyl­sulfon­yl)imide] anions, and one water mol­ecule of crystallization (point group 2). The Fe—N bond lengths are indicative of a d (6) low-spin state for the Fe(II) ion in the complex. The dihedral angle between the phen ligands in the cation is 87.64 (6)°. The Tf(2)N(−) counter-anion is non-coordinating, with the –CF(3) groups arranged in a trans fashion with respect to each other, leading to an anti,anti conformation of the –CF(3) groups and –SO(2)N– moieties relative to the S—C bonds. The water mol­ecule of crystallization connects two O atoms of the Tf(2)N(−) anions through weak hydrogen bonds. C—H⋯O hydrogen-bonding inter­actions are also observed, consolidating the packing of the mol­ecules into a three-dimensional network structure.
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spelling pubmed-43318862015-02-20 Crystal structure of tris­(1,10-phenanthroline-κ(2) N,N′)iron(II) bis­[bis­(tri­fluoro­methyl­sulfon­yl)imide] monohydrate Teramoto, Kazunori Kawasaki, Takeshi Nishide, Toshikazu Ikeda, Yasuhisa Acta Crystallogr E Crystallogr Commun Data Reports The crystal structure of the title complex, [Fe(C(12)H(8)N(2))(3)][(CF(3)SO(2))(2)N](2)·H(2)O, is constructed by one octa­hedral [Fe(phen)(3)](2+) (phen = 1,10-phenanthroline) cation (point group symmetry 2), two Tf(2)N(−) [bis­(tri­fluoromethyl­sulfon­yl)imide] anions, and one water mol­ecule of crystallization (point group 2). The Fe—N bond lengths are indicative of a d (6) low-spin state for the Fe(II) ion in the complex. The dihedral angle between the phen ligands in the cation is 87.64 (6)°. The Tf(2)N(−) counter-anion is non-coordinating, with the –CF(3) groups arranged in a trans fashion with respect to each other, leading to an anti,anti conformation of the –CF(3) groups and –SO(2)N– moieties relative to the S—C bonds. The water mol­ecule of crystallization connects two O atoms of the Tf(2)N(−) anions through weak hydrogen bonds. C—H⋯O hydrogen-bonding inter­actions are also observed, consolidating the packing of the mol­ecules into a three-dimensional network structure. International Union of Crystallography 2015-01-01 /pmc/articles/PMC4331886/ /pubmed/25705476 http://dx.doi.org/10.1107/S2056989014026966 Text en © Teramoto et al. 2015 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 Data Reports
Teramoto, Kazunori
Kawasaki, Takeshi
Nishide, Toshikazu
Ikeda, Yasuhisa
Crystal structure of tris­(1,10-phenanthroline-κ(2) N,N′)iron(II) bis­[bis­(tri­fluoro­methyl­sulfon­yl)imide] monohydrate
title Crystal structure of tris­(1,10-phenanthroline-κ(2) N,N′)iron(II) bis­[bis­(tri­fluoro­methyl­sulfon­yl)imide] monohydrate
title_full Crystal structure of tris­(1,10-phenanthroline-κ(2) N,N′)iron(II) bis­[bis­(tri­fluoro­methyl­sulfon­yl)imide] monohydrate
title_fullStr Crystal structure of tris­(1,10-phenanthroline-κ(2) N,N′)iron(II) bis­[bis­(tri­fluoro­methyl­sulfon­yl)imide] monohydrate
title_full_unstemmed Crystal structure of tris­(1,10-phenanthroline-κ(2) N,N′)iron(II) bis­[bis­(tri­fluoro­methyl­sulfon­yl)imide] monohydrate
title_short Crystal structure of tris­(1,10-phenanthroline-κ(2) N,N′)iron(II) bis­[bis­(tri­fluoro­methyl­sulfon­yl)imide] monohydrate
title_sort crystal structure of tris­(1,10-phenanthroline-κ(2) n,n′)iron(ii) bis­[bis­(tri­fluoro­methyl­sulfon­yl)imide] monohydrate
topic Data Reports
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4331886/
https://www.ncbi.nlm.nih.gov/pubmed/25705476
http://dx.doi.org/10.1107/S2056989014026966
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