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Hemipiperazinediium bis(pyridine-2,6-dicarboxylato-κ(3) O,N,O′)gallate(III) pyridine-2,6-dicarboxylic acid dihydrate
The asymmetric unit of the title compound, (C(4)H(12)N(2))(0.5)[Ga(pydc)(2)]·pydcH(2)·2H(2)O, where pydcH(2) is pyridine-2,6-dicarboxylic acid, C(7)H(5)NO(4), contains one half of a centrosymmetric piperazinediium dication, one anion, one uncoordinated pydcH(2) molecule and two uncoordinated water...
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Formato: | Texto |
Lenguaje: | English |
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International Union of Crystallography
2008
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2959419/ https://www.ncbi.nlm.nih.gov/pubmed/21201039 http://dx.doi.org/10.1107/S1600536808029140 |
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author | Rafizadeh, Masoud Nemati, Andya Derikvand, Zohreh |
author_facet | Rafizadeh, Masoud Nemati, Andya Derikvand, Zohreh |
author_sort | Rafizadeh, Masoud |
collection | PubMed |
description | The asymmetric unit of the title compound, (C(4)H(12)N(2))(0.5)[Ga(pydc)(2)]·pydcH(2)·2H(2)O, where pydcH(2) is pyridine-2,6-dicarboxylic acid, C(7)H(5)NO(4), contains one half of a centrosymmetric piperazinediium dication, one anion, one uncoordinated pydcH(2) molecule and two uncoordinated water molecules, one of which is disordered over two sites in a 1:1 ratio. In the anion, the Ga(III) ion is coordinated by four O atoms [Ga—O = 1.9706 (16)–2.0494 (15) Å] and two N atoms [Ga—N = 1.9660 (18) and 1.9709 (17) Å] from two pydc ligands in a distorted octahedral geometry. The crystal structure exhibits intermolecular O—H⋯O, N—H⋯O and O—H⋯N hydrogen bonds and π–π interactions [centroid–centroid distances of 3.5359 (13) and 3.6550 (14) Å]. |
format | Text |
id | pubmed-2959419 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2008 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-29594192010-12-30 Hemipiperazinediium bis(pyridine-2,6-dicarboxylato-κ(3) O,N,O′)gallate(III) pyridine-2,6-dicarboxylic acid dihydrate Rafizadeh, Masoud Nemati, Andya Derikvand, Zohreh Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers The asymmetric unit of the title compound, (C(4)H(12)N(2))(0.5)[Ga(pydc)(2)]·pydcH(2)·2H(2)O, where pydcH(2) is pyridine-2,6-dicarboxylic acid, C(7)H(5)NO(4), contains one half of a centrosymmetric piperazinediium dication, one anion, one uncoordinated pydcH(2) molecule and two uncoordinated water molecules, one of which is disordered over two sites in a 1:1 ratio. In the anion, the Ga(III) ion is coordinated by four O atoms [Ga—O = 1.9706 (16)–2.0494 (15) Å] and two N atoms [Ga—N = 1.9660 (18) and 1.9709 (17) Å] from two pydc ligands in a distorted octahedral geometry. The crystal structure exhibits intermolecular O—H⋯O, N—H⋯O and O—H⋯N hydrogen bonds and π–π interactions [centroid–centroid distances of 3.5359 (13) and 3.6550 (14) Å]. International Union of Crystallography 2008-09-20 /pmc/articles/PMC2959419/ /pubmed/21201039 http://dx.doi.org/10.1107/S1600536808029140 Text en © Rafizadeh et al. 2008 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 Rafizadeh, Masoud Nemati, Andya Derikvand, Zohreh Hemipiperazinediium bis(pyridine-2,6-dicarboxylato-κ(3) O,N,O′)gallate(III) pyridine-2,6-dicarboxylic acid dihydrate |
title | Hemipiperazinediium bis(pyridine-2,6-dicarboxylato-κ(3)
O,N,O′)gallate(III) pyridine-2,6-dicarboxylic acid dihydrate |
title_full | Hemipiperazinediium bis(pyridine-2,6-dicarboxylato-κ(3)
O,N,O′)gallate(III) pyridine-2,6-dicarboxylic acid dihydrate |
title_fullStr | Hemipiperazinediium bis(pyridine-2,6-dicarboxylato-κ(3)
O,N,O′)gallate(III) pyridine-2,6-dicarboxylic acid dihydrate |
title_full_unstemmed | Hemipiperazinediium bis(pyridine-2,6-dicarboxylato-κ(3)
O,N,O′)gallate(III) pyridine-2,6-dicarboxylic acid dihydrate |
title_short | Hemipiperazinediium bis(pyridine-2,6-dicarboxylato-κ(3)
O,N,O′)gallate(III) pyridine-2,6-dicarboxylic acid dihydrate |
title_sort | hemipiperazinediium bis(pyridine-2,6-dicarboxylato-κ(3)
o,n,o′)gallate(iii) pyridine-2,6-dicarboxylic acid dihydrate |
topic | Metal-Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2959419/ https://www.ncbi.nlm.nih.gov/pubmed/21201039 http://dx.doi.org/10.1107/S1600536808029140 |
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