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Bromidobis(1,10-phenanthroline-κ(2) N,N′)copper(II) dicyanamidate

The title compound, [CuBr(C(12)H(8)N(2))(2)][N(CN)(2)], is formed of discrete [CuBr(phen)(2)](+) complex cations and uncoordinated [N(CN)(2)](−) anions (phen is 1,10-phenanthroline). The Cu atom is five-coordinated in a distorted trigonal-bipyramidal geometry by two phen mol­ecules and one bromide l...

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Autores principales: Potočňák, Ivan, Pravcová, Zuzana, Rak, Dmytro
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2010
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2983267/
https://www.ncbi.nlm.nih.gov/pubmed/21587458
http://dx.doi.org/10.1107/S1600536810037979
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author Potočňák, Ivan
Pravcová, Zuzana
Rak, Dmytro
author_facet Potočňák, Ivan
Pravcová, Zuzana
Rak, Dmytro
author_sort Potočňák, Ivan
collection PubMed
description The title compound, [CuBr(C(12)H(8)N(2))(2)][N(CN)(2)], is formed of discrete [CuBr(phen)(2)](+) complex cations and uncoordinated [N(CN)(2)](−) anions (phen is 1,10-phenanthroline). The Cu atom is five-coordinated in a distorted trigonal-bipyramidal geometry by two phen mol­ecules and one bromide ligand, which coordinates in the equatorial plane at a distance of 2.5228 (4) Å and lying along with the Cu and the amide N atoms on a twofold rotation axis. The two axial Cu—N distances [1.9926 (15) Å] are slightly shorter than the two equatorial Cu—N bonds [2.0979 (15) Å]. The structure is stabilized by a weak C—H⋯N hydrogen bond, with a cyanide N atom of the dicyanamide ligand as an acceptor, and π–π inter­actions between nearly parallel phenyl and pyridine rings of two adjacent phen mol­ecules [centroid–centroid distance = 3.589 (1) Å], and between π electrons of the dicyanamide anion and the pyridine ring [N⋯Cg(pyridine) = 3.511 (3) Å; C—N⋯Cg(pyridine) = 80.2 (2)°].
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spelling pubmed-29832672010-12-30 Bromidobis(1,10-phenanthroline-κ(2) N,N′)copper(II) dicyanamidate Potočňák, Ivan Pravcová, Zuzana Rak, Dmytro Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers The title compound, [CuBr(C(12)H(8)N(2))(2)][N(CN)(2)], is formed of discrete [CuBr(phen)(2)](+) complex cations and uncoordinated [N(CN)(2)](−) anions (phen is 1,10-phenanthroline). The Cu atom is five-coordinated in a distorted trigonal-bipyramidal geometry by two phen mol­ecules and one bromide ligand, which coordinates in the equatorial plane at a distance of 2.5228 (4) Å and lying along with the Cu and the amide N atoms on a twofold rotation axis. The two axial Cu—N distances [1.9926 (15) Å] are slightly shorter than the two equatorial Cu—N bonds [2.0979 (15) Å]. The structure is stabilized by a weak C—H⋯N hydrogen bond, with a cyanide N atom of the dicyanamide ligand as an acceptor, and π–π inter­actions between nearly parallel phenyl and pyridine rings of two adjacent phen mol­ecules [centroid–centroid distance = 3.589 (1) Å], and between π electrons of the dicyanamide anion and the pyridine ring [N⋯Cg(pyridine) = 3.511 (3) Å; C—N⋯Cg(pyridine) = 80.2 (2)°]. International Union of Crystallography 2010-09-30 /pmc/articles/PMC2983267/ /pubmed/21587458 http://dx.doi.org/10.1107/S1600536810037979 Text en © Potočňák et al. 2010 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
Potočňák, Ivan
Pravcová, Zuzana
Rak, Dmytro
Bromidobis(1,10-phenanthroline-κ(2) N,N′)copper(II) dicyanamidate
title Bromidobis(1,10-phenanthroline-κ(2) N,N′)copper(II) dicyanamidate
title_full Bromidobis(1,10-phenanthroline-κ(2) N,N′)copper(II) dicyanamidate
title_fullStr Bromidobis(1,10-phenanthroline-κ(2) N,N′)copper(II) dicyanamidate
title_full_unstemmed Bromidobis(1,10-phenanthroline-κ(2) N,N′)copper(II) dicyanamidate
title_short Bromidobis(1,10-phenanthroline-κ(2) N,N′)copper(II) dicyanamidate
title_sort bromidobis(1,10-phenanthroline-κ(2) n,n′)copper(ii) dicyanamidate
topic Metal-Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2983267/
https://www.ncbi.nlm.nih.gov/pubmed/21587458
http://dx.doi.org/10.1107/S1600536810037979
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