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Poly[bis(μ(2)-pyrimidine-2-carboxylato-κ(4) O,N:O′,N′)calcium]
In the crystal structure of the title polymeric complex, [Ca(C(5)H(3)N(2)O(2))(2)](n), the Ca(II) cation has site symmetry [Image: see text] m2 and is N,O-chelated by four pyrimidine-2-carboxylate anions in a square-antiprismatic geometry. The planar pyrimidine-2-carboxylate anion is located on a...
Autores principales: | , , |
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Formato: | Texto |
Lenguaje: | English |
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International Union of Crystallography
2009
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2977290/ https://www.ncbi.nlm.nih.gov/pubmed/21583343 http://dx.doi.org/10.1107/S1600536809025537 |
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author | Zhang, Bing-Yu Nie, Jing-Jing Xu, Duan-Jun |
author_facet | Zhang, Bing-Yu Nie, Jing-Jing Xu, Duan-Jun |
author_sort | Zhang, Bing-Yu |
collection | PubMed |
description | In the crystal structure of the title polymeric complex, [Ca(C(5)H(3)N(2)O(2))(2)](n), the Ca(II) cation has site symmetry [Image: see text] m2 and is N,O-chelated by four pyrimidine-2-carboxylate anions in a square-antiprismatic geometry. The planar pyrimidine-2-carboxylate anion is located on a crystallographic special position, three C atoms have site symmetry 2mm, while the carboxyl O atom, the pyrimidine N atom and the other C atom have site symmetry m. Each pyrimidine-2-carboxylate anion bridges two Ca(II) cations, forming polymeric sheets extending parallel to (001). π–π stacking exists between parallel pyrimidine rings [centroid–centroid distance = 3.6436 (6) Å] of adjacent polymeric sheets. Weak C—H⋯O hydrogen bonding is also observed between these sheets. |
format | Text |
id | pubmed-2977290 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2009 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-29772902010-12-30 Poly[bis(μ(2)-pyrimidine-2-carboxylato-κ(4) O,N:O′,N′)calcium] Zhang, Bing-Yu Nie, Jing-Jing Xu, Duan-Jun Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers In the crystal structure of the title polymeric complex, [Ca(C(5)H(3)N(2)O(2))(2)](n), the Ca(II) cation has site symmetry [Image: see text] m2 and is N,O-chelated by four pyrimidine-2-carboxylate anions in a square-antiprismatic geometry. The planar pyrimidine-2-carboxylate anion is located on a crystallographic special position, three C atoms have site symmetry 2mm, while the carboxyl O atom, the pyrimidine N atom and the other C atom have site symmetry m. Each pyrimidine-2-carboxylate anion bridges two Ca(II) cations, forming polymeric sheets extending parallel to (001). π–π stacking exists between parallel pyrimidine rings [centroid–centroid distance = 3.6436 (6) Å] of adjacent polymeric sheets. Weak C—H⋯O hydrogen bonding is also observed between these sheets. International Union of Crystallography 2009-07-08 /pmc/articles/PMC2977290/ /pubmed/21583343 http://dx.doi.org/10.1107/S1600536809025537 Text en © Zhang et al. 2009 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 Zhang, Bing-Yu Nie, Jing-Jing Xu, Duan-Jun Poly[bis(μ(2)-pyrimidine-2-carboxylato-κ(4) O,N:O′,N′)calcium] |
title | Poly[bis(μ(2)-pyrimidine-2-carboxylato-κ(4)
O,N:O′,N′)calcium] |
title_full | Poly[bis(μ(2)-pyrimidine-2-carboxylato-κ(4)
O,N:O′,N′)calcium] |
title_fullStr | Poly[bis(μ(2)-pyrimidine-2-carboxylato-κ(4)
O,N:O′,N′)calcium] |
title_full_unstemmed | Poly[bis(μ(2)-pyrimidine-2-carboxylato-κ(4)
O,N:O′,N′)calcium] |
title_short | Poly[bis(μ(2)-pyrimidine-2-carboxylato-κ(4)
O,N:O′,N′)calcium] |
title_sort | poly[bis(μ(2)-pyrimidine-2-carboxylato-κ(4)
o,n:o′,n′)calcium] |
topic | Metal-Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2977290/ https://www.ncbi.nlm.nih.gov/pubmed/21583343 http://dx.doi.org/10.1107/S1600536809025537 |
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