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Crystal structure of tetraaquabis(3,5-diamino-4H-1,2,4-triazol-1-ium)cobalt(II) bis[bis(pyridine-2,6-dicarboxylato)cobaltate(II)] dihydrate
The asymmetric unit of the title compound, [Co(C(2)H(6)N(5))(2)(H(2)O)(4)][Co(C(7)H(3)NO(4))(2)](2)·2H(2)O, features 1.5 Co(II) ions (one anionic complex and one half cationic complex) and one water molecule. In the cationic complex, the Co(II) atom is located on an inversion centre and is coordina...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2015
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4459343/ https://www.ncbi.nlm.nih.gov/pubmed/26090171 http://dx.doi.org/10.1107/S2056989015010014 |
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author | Johnson, Atim Mbonu, Justina Hussain, Zahid Loh, Wan-Sin Fun, Hoong-Kun |
author_facet | Johnson, Atim Mbonu, Justina Hussain, Zahid Loh, Wan-Sin Fun, Hoong-Kun |
author_sort | Johnson, Atim |
collection | PubMed |
description | The asymmetric unit of the title compound, [Co(C(2)H(6)N(5))(2)(H(2)O)(4)][Co(C(7)H(3)NO(4))(2)](2)·2H(2)O, features 1.5 Co(II) ions (one anionic complex and one half cationic complex) and one water molecule. In the cationic complex, the Co(II) atom is located on an inversion centre and is coordinated by two triazolium cations and four water molecules, adopting an octahedral geometry where the N atoms of the two triazolium cations occupy the axial positions and the O atoms of the four water molecules the equatorial positions. The two triazole ligands are parallel offset (with a distance of 1.38 Å between their planes). In the anionic complex, the Co(II) ion is six-coordinated by two N and four O atoms of the two pyridine-2,6-dicarboxylate anions, exhibiting a slightly distorted octahedral coordination geometry in which the mean plane of the two pyridine-2,6-dicarboxylate anions are almost perpendicular to each other, making a dihedral angle of 85.87 (2)°. In the crystal, molecules are linked into a three-dimensional network via C—H⋯O, C—H⋯N, O—H⋯O and N—H⋯O hydrogen bonds. |
format | Online Article Text |
id | pubmed-4459343 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2015 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-44593432015-06-18 Crystal structure of tetraaquabis(3,5-diamino-4H-1,2,4-triazol-1-ium)cobalt(II) bis[bis(pyridine-2,6-dicarboxylato)cobaltate(II)] dihydrate Johnson, Atim Mbonu, Justina Hussain, Zahid Loh, Wan-Sin Fun, Hoong-Kun Acta Crystallogr E Crystallogr Commun Data Reports The asymmetric unit of the title compound, [Co(C(2)H(6)N(5))(2)(H(2)O)(4)][Co(C(7)H(3)NO(4))(2)](2)·2H(2)O, features 1.5 Co(II) ions (one anionic complex and one half cationic complex) and one water molecule. In the cationic complex, the Co(II) atom is located on an inversion centre and is coordinated by two triazolium cations and four water molecules, adopting an octahedral geometry where the N atoms of the two triazolium cations occupy the axial positions and the O atoms of the four water molecules the equatorial positions. The two triazole ligands are parallel offset (with a distance of 1.38 Å between their planes). In the anionic complex, the Co(II) ion is six-coordinated by two N and four O atoms of the two pyridine-2,6-dicarboxylate anions, exhibiting a slightly distorted octahedral coordination geometry in which the mean plane of the two pyridine-2,6-dicarboxylate anions are almost perpendicular to each other, making a dihedral angle of 85.87 (2)°. In the crystal, molecules are linked into a three-dimensional network via C—H⋯O, C—H⋯N, O—H⋯O and N—H⋯O hydrogen bonds. International Union of Crystallography 2015-05-30 /pmc/articles/PMC4459343/ /pubmed/26090171 http://dx.doi.org/10.1107/S2056989015010014 Text en © Johnson 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 Johnson, Atim Mbonu, Justina Hussain, Zahid Loh, Wan-Sin Fun, Hoong-Kun Crystal structure of tetraaquabis(3,5-diamino-4H-1,2,4-triazol-1-ium)cobalt(II) bis[bis(pyridine-2,6-dicarboxylato)cobaltate(II)] dihydrate |
title | Crystal structure of tetraaquabis(3,5-diamino-4H-1,2,4-triazol-1-ium)cobalt(II) bis[bis(pyridine-2,6-dicarboxylato)cobaltate(II)] dihydrate |
title_full | Crystal structure of tetraaquabis(3,5-diamino-4H-1,2,4-triazol-1-ium)cobalt(II) bis[bis(pyridine-2,6-dicarboxylato)cobaltate(II)] dihydrate |
title_fullStr | Crystal structure of tetraaquabis(3,5-diamino-4H-1,2,4-triazol-1-ium)cobalt(II) bis[bis(pyridine-2,6-dicarboxylato)cobaltate(II)] dihydrate |
title_full_unstemmed | Crystal structure of tetraaquabis(3,5-diamino-4H-1,2,4-triazol-1-ium)cobalt(II) bis[bis(pyridine-2,6-dicarboxylato)cobaltate(II)] dihydrate |
title_short | Crystal structure of tetraaquabis(3,5-diamino-4H-1,2,4-triazol-1-ium)cobalt(II) bis[bis(pyridine-2,6-dicarboxylato)cobaltate(II)] dihydrate |
title_sort | crystal structure of tetraaquabis(3,5-diamino-4h-1,2,4-triazol-1-ium)cobalt(ii) bis[bis(pyridine-2,6-dicarboxylato)cobaltate(ii)] dihydrate |
topic | Data Reports |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4459343/ https://www.ncbi.nlm.nih.gov/pubmed/26090171 http://dx.doi.org/10.1107/S2056989015010014 |
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