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Crystal structure of bis[(1-ammonio-1-phosphonoethyl)phosphonato]tetraaquacadmium dihydrate: a powder X-ray diffraction study
In the title compound, [CdL (2)(H(2)O)(4)]·2H(2)O [L = (1-ammonio-1-phosphonoethyl)phosphonate, C(2)H(8)NO(6)P(2) (−)], the Cd(II) ion is situated on an inversion centre being coordinated by four aqua molecules in the equatorial plane and two phosphonate O atoms from two deprotonated L ligands i...
Autores principales: | , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
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International Union of Crystallography
2015
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4438848/ https://www.ncbi.nlm.nih.gov/pubmed/26029385 http://dx.doi.org/10.1107/S2056989015004028 |
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author | Rukiah, Mwaffak Assaad, Thaer |
author_facet | Rukiah, Mwaffak Assaad, Thaer |
author_sort | Rukiah, Mwaffak |
collection | PubMed |
description | In the title compound, [CdL (2)(H(2)O)(4)]·2H(2)O [L = (1-ammonio-1-phosphonoethyl)phosphonate, C(2)H(8)NO(6)P(2) (−)], the Cd(II) ion is situated on an inversion centre being coordinated by four aqua molecules in the equatorial plane and two phosphonate O atoms from two deprotonated L ligands in the axial positions in a distorted octahedral geometry. The asymmetric unit contains one-half of the complex molecule and one lattice water molecule. The ligand L exists in a zwitterionic form, with a positive charge on the NH(3) group and a negative charge on the O atom of the non-coordinating phosphonate group, and with an intramolecular O—H⋯O interaction forming an S(6) ring motif and two intramolecular N—H⋯O interactions each generating an S(5) ring motif. In the crystal, N—H⋯O and O—H⋯O hydrogen bonds link the complex molecules into a three-dimensional network in which the voids of 38 Å(3) are filled with ordered lattice water molecules, which are also involved in O—H⋯O hydrogen bonding. |
format | Online Article Text |
id | pubmed-4438848 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2015 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-44388482015-05-30 Crystal structure of bis[(1-ammonio-1-phosphonoethyl)phosphonato]tetraaquacadmium dihydrate: a powder X-ray diffraction study Rukiah, Mwaffak Assaad, Thaer Acta Crystallogr E Crystallogr Commun Research Communications In the title compound, [CdL (2)(H(2)O)(4)]·2H(2)O [L = (1-ammonio-1-phosphonoethyl)phosphonate, C(2)H(8)NO(6)P(2) (−)], the Cd(II) ion is situated on an inversion centre being coordinated by four aqua molecules in the equatorial plane and two phosphonate O atoms from two deprotonated L ligands in the axial positions in a distorted octahedral geometry. The asymmetric unit contains one-half of the complex molecule and one lattice water molecule. The ligand L exists in a zwitterionic form, with a positive charge on the NH(3) group and a negative charge on the O atom of the non-coordinating phosphonate group, and with an intramolecular O—H⋯O interaction forming an S(6) ring motif and two intramolecular N—H⋯O interactions each generating an S(5) ring motif. In the crystal, N—H⋯O and O—H⋯O hydrogen bonds link the complex molecules into a three-dimensional network in which the voids of 38 Å(3) are filled with ordered lattice water molecules, which are also involved in O—H⋯O hydrogen bonding. International Union of Crystallography 2015-03-07 /pmc/articles/PMC4438848/ /pubmed/26029385 http://dx.doi.org/10.1107/S2056989015004028 Text en © Rukiah and Assaad 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 | Research Communications Rukiah, Mwaffak Assaad, Thaer Crystal structure of bis[(1-ammonio-1-phosphonoethyl)phosphonato]tetraaquacadmium dihydrate: a powder X-ray diffraction study |
title | Crystal structure of bis[(1-ammonio-1-phosphonoethyl)phosphonato]tetraaquacadmium dihydrate: a powder X-ray diffraction study |
title_full | Crystal structure of bis[(1-ammonio-1-phosphonoethyl)phosphonato]tetraaquacadmium dihydrate: a powder X-ray diffraction study |
title_fullStr | Crystal structure of bis[(1-ammonio-1-phosphonoethyl)phosphonato]tetraaquacadmium dihydrate: a powder X-ray diffraction study |
title_full_unstemmed | Crystal structure of bis[(1-ammonio-1-phosphonoethyl)phosphonato]tetraaquacadmium dihydrate: a powder X-ray diffraction study |
title_short | Crystal structure of bis[(1-ammonio-1-phosphonoethyl)phosphonato]tetraaquacadmium dihydrate: a powder X-ray diffraction study |
title_sort | crystal structure of bis[(1-ammonio-1-phosphonoethyl)phosphonato]tetraaquacadmium dihydrate: a powder x-ray diffraction study |
topic | Research Communications |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4438848/ https://www.ncbi.nlm.nih.gov/pubmed/26029385 http://dx.doi.org/10.1107/S2056989015004028 |
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