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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...

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Autores principales: Rukiah, Mwaffak, Assaad, Thaer
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2015
Materias:
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.
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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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