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Chloridobis(1,10-phenanthroline-κ(2) N,N′)copper(II) chlorido(1,10-phenanthroline-κ(2) N,N′)(pyridine-2,6-dicarboxylato-κ(3) O (2),N,O (6))manganate(II) methanol monosolvate
The title complex, [CuCl(C(12)H(8)N(2))(2)][Mn(C(7)H(3)NO(4))Cl(C(12)H(8)N(2))]·CH(3)OH, consists of discrete [CuCl(phen)(2)](+) cations (phen is 1,10-phenanthroline), [MnCl(pydc)(phen)](−) anions (H(2)pydc is 2,6-pyridine-2,6-dicarboxylic acid) and one methanol solvent molecule of crystallizati...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2014
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3998582/ https://www.ncbi.nlm.nih.gov/pubmed/24826106 http://dx.doi.org/10.1107/S1600536814006369 |
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author | Buvailo, Halyna I. Rusanova, Julia A. Makhankova, Valeriya G. Kokozay, Vladimir N. Zubatyuk, Roman I. |
author_facet | Buvailo, Halyna I. Rusanova, Julia A. Makhankova, Valeriya G. Kokozay, Vladimir N. Zubatyuk, Roman I. |
author_sort | Buvailo, Halyna I. |
collection | PubMed |
description | The title complex, [CuCl(C(12)H(8)N(2))(2)][Mn(C(7)H(3)NO(4))Cl(C(12)H(8)N(2))]·CH(3)OH, consists of discrete [CuCl(phen)(2)](+) cations (phen is 1,10-phenanthroline), [MnCl(pydc)(phen)](−) anions (H(2)pydc is 2,6-pyridine-2,6-dicarboxylic acid) and one methanol solvent molecule of crystallization per asymmetric unit. It should be noted, that a solvent-masking procedure as implemented in OLEX2 [Dolomanov et al. (2009). J. Appl. Cryst. 42, 339–341 ▶] was used to remove the electronic contribution from one disordered solvent molecule, presumably methanol. Only the atoms used in the refined model are reported in chemical formula and related values. The Cu(II) ion is five-coordinated by two phenanthroline ligands and one chloride ion in a distorted trigonal–bipyramidal geometry. The dihedral angle between the phen ligands is 65.21 (5)°. The Mn(II) ion is six-coordinated by one Cl atom, two N atoms from a phen ligand, as well one N atom and two O atoms from pydc in a distorted octahedral coordination geometry, with cis angles ranging from 72.00 (8) to 122.07 (8)° and trans angles ranging from 143.98 (8) to 163.15 (6)°. In the crystal, C—H⋯O, O—H⋯O and C—H⋯Cl hydrogen bonds, cation–anion π–π interactions between the phen ring systems with centroid–centroid distances in the range 3.881 (34)–4.123 (36) Å, as well as cation–cation, anion–anion π–π interactions between the phen rings with centroid–centroid distances in the range 3.763 (4)–3.99 (5) Å and pydc rings with centroid–centroid distances 3.52 (5) Å link the various components. |
format | Online Article Text |
id | pubmed-3998582 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2014 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-39985822014-05-13 Chloridobis(1,10-phenanthroline-κ(2) N,N′)copper(II) chlorido(1,10-phenanthroline-κ(2) N,N′)(pyridine-2,6-dicarboxylato-κ(3) O (2),N,O (6))manganate(II) methanol monosolvate Buvailo, Halyna I. Rusanova, Julia A. Makhankova, Valeriya G. Kokozay, Vladimir N. Zubatyuk, Roman I. Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers The title complex, [CuCl(C(12)H(8)N(2))(2)][Mn(C(7)H(3)NO(4))Cl(C(12)H(8)N(2))]·CH(3)OH, consists of discrete [CuCl(phen)(2)](+) cations (phen is 1,10-phenanthroline), [MnCl(pydc)(phen)](−) anions (H(2)pydc is 2,6-pyridine-2,6-dicarboxylic acid) and one methanol solvent molecule of crystallization per asymmetric unit. It should be noted, that a solvent-masking procedure as implemented in OLEX2 [Dolomanov et al. (2009). J. Appl. Cryst. 42, 339–341 ▶] was used to remove the electronic contribution from one disordered solvent molecule, presumably methanol. Only the atoms used in the refined model are reported in chemical formula and related values. The Cu(II) ion is five-coordinated by two phenanthroline ligands and one chloride ion in a distorted trigonal–bipyramidal geometry. The dihedral angle between the phen ligands is 65.21 (5)°. The Mn(II) ion is six-coordinated by one Cl atom, two N atoms from a phen ligand, as well one N atom and two O atoms from pydc in a distorted octahedral coordination geometry, with cis angles ranging from 72.00 (8) to 122.07 (8)° and trans angles ranging from 143.98 (8) to 163.15 (6)°. In the crystal, C—H⋯O, O—H⋯O and C—H⋯Cl hydrogen bonds, cation–anion π–π interactions between the phen ring systems with centroid–centroid distances in the range 3.881 (34)–4.123 (36) Å, as well as cation–cation, anion–anion π–π interactions between the phen rings with centroid–centroid distances in the range 3.763 (4)–3.99 (5) Å and pydc rings with centroid–centroid distances 3.52 (5) Å link the various components. International Union of Crystallography 2014-03-29 /pmc/articles/PMC3998582/ /pubmed/24826106 http://dx.doi.org/10.1107/S1600536814006369 Text en © Buvailo et al. 2014 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 Buvailo, Halyna I. Rusanova, Julia A. Makhankova, Valeriya G. Kokozay, Vladimir N. Zubatyuk, Roman I. Chloridobis(1,10-phenanthroline-κ(2) N,N′)copper(II) chlorido(1,10-phenanthroline-κ(2) N,N′)(pyridine-2,6-dicarboxylato-κ(3) O (2),N,O (6))manganate(II) methanol monosolvate |
title | Chloridobis(1,10-phenanthroline-κ(2)
N,N′)copper(II) chlorido(1,10-phenanthroline-κ(2)
N,N′)(pyridine-2,6-dicarboxylato-κ(3)
O
(2),N,O
(6))manganate(II) methanol monosolvate |
title_full | Chloridobis(1,10-phenanthroline-κ(2)
N,N′)copper(II) chlorido(1,10-phenanthroline-κ(2)
N,N′)(pyridine-2,6-dicarboxylato-κ(3)
O
(2),N,O
(6))manganate(II) methanol monosolvate |
title_fullStr | Chloridobis(1,10-phenanthroline-κ(2)
N,N′)copper(II) chlorido(1,10-phenanthroline-κ(2)
N,N′)(pyridine-2,6-dicarboxylato-κ(3)
O
(2),N,O
(6))manganate(II) methanol monosolvate |
title_full_unstemmed | Chloridobis(1,10-phenanthroline-κ(2)
N,N′)copper(II) chlorido(1,10-phenanthroline-κ(2)
N,N′)(pyridine-2,6-dicarboxylato-κ(3)
O
(2),N,O
(6))manganate(II) methanol monosolvate |
title_short | Chloridobis(1,10-phenanthroline-κ(2)
N,N′)copper(II) chlorido(1,10-phenanthroline-κ(2)
N,N′)(pyridine-2,6-dicarboxylato-κ(3)
O
(2),N,O
(6))manganate(II) methanol monosolvate |
title_sort | chloridobis(1,10-phenanthroline-κ(2)
n,n′)copper(ii) chlorido(1,10-phenanthroline-κ(2)
n,n′)(pyridine-2,6-dicarboxylato-κ(3)
o
(2),n,o
(6))manganate(ii) methanol monosolvate |
topic | Metal-Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3998582/ https://www.ncbi.nlm.nih.gov/pubmed/24826106 http://dx.doi.org/10.1107/S1600536814006369 |
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