Cargando…

Penta­aqua­tri-μ(3)-hydroxido-tris­(imino­diacetato)-μ(3)-oxido-tetra­hedro-calcium(II)tricobalt(III) 2.54-hydrate

In the title compound, [CaCo(3)(C(4)H(5)NO(4))(3)(OH)(3)O(H(2)O)(5)]·2.54H(2)O, the Co atom is octa­hedrally coordinated by one imino­diacetate (ida) dianion as a facial O,N,O′-tridentate ligand, two μ(3)-OH groups and one μ(3)-O ligand, forming an partial Co(3)O(4) cubane cluster. This unit coordin...

Descripción completa

Detalles Bibliográficos
Autores principales: Ama, Tomoharu, Yonemura, Toshiaki, Morita, Shogo, Yamaguchi, Masanori
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2010
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2984083/
https://www.ncbi.nlm.nih.gov/pubmed/21580563
http://dx.doi.org/10.1107/S1600536810010998
_version_ 1782192030737235968
author Ama, Tomoharu
Yonemura, Toshiaki
Morita, Shogo
Yamaguchi, Masanori
author_facet Ama, Tomoharu
Yonemura, Toshiaki
Morita, Shogo
Yamaguchi, Masanori
author_sort Ama, Tomoharu
collection PubMed
description In the title compound, [CaCo(3)(C(4)H(5)NO(4))(3)(OH)(3)O(H(2)O)(5)]·2.54H(2)O, the Co atom is octa­hedrally coordinated by one imino­diacetate (ida) dianion as a facial O,N,O′-tridentate ligand, two μ(3)-OH groups and one μ(3)-O ligand, forming an partial Co(3)O(4) cubane cluster. This unit coordinates to a Ca(II) cation in an O,O′,O′′-tridentate fashion, generating a distorted CaCo(3)O(4) cubane-type cluster. The Ca—μ(3)-O distances [2.429 (5)–2.572 (6) Å] are much longer than the Co—μ(3)—O bonds [1.895 (5)–1.941 (5) Å]. The Ca(II) cation is also coord­inated by five water mol­ecules with Ca—O distances in the range 2.355 (6)–2.543 (6) Å. There are three additional uncoordinated water mol­ecules in the asymmetric unit, the occupancy of which refined to 0.54 (3). In H(2)O (or D(2)O), the title complex hydrolyses to Ca(2+) (aq) cations and [Co(3)(ida)(3)(μ(2)-OH)(3)(μ(3)-O)](2−) anions.
format Text
id pubmed-2984083
institution National Center for Biotechnology Information
language English
publishDate 2010
publisher International Union of Crystallography
record_format MEDLINE/PubMed
spelling pubmed-29840832010-12-30 Penta­aqua­tri-μ(3)-hydroxido-tris­(imino­diacetato)-μ(3)-oxido-tetra­hedro-calcium(II)tricobalt(III) 2.54-hydrate Ama, Tomoharu Yonemura, Toshiaki Morita, Shogo Yamaguchi, Masanori Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers In the title compound, [CaCo(3)(C(4)H(5)NO(4))(3)(OH)(3)O(H(2)O)(5)]·2.54H(2)O, the Co atom is octa­hedrally coordinated by one imino­diacetate (ida) dianion as a facial O,N,O′-tridentate ligand, two μ(3)-OH groups and one μ(3)-O ligand, forming an partial Co(3)O(4) cubane cluster. This unit coordinates to a Ca(II) cation in an O,O′,O′′-tridentate fashion, generating a distorted CaCo(3)O(4) cubane-type cluster. The Ca—μ(3)-O distances [2.429 (5)–2.572 (6) Å] are much longer than the Co—μ(3)—O bonds [1.895 (5)–1.941 (5) Å]. The Ca(II) cation is also coord­inated by five water mol­ecules with Ca—O distances in the range 2.355 (6)–2.543 (6) Å. There are three additional uncoordinated water mol­ecules in the asymmetric unit, the occupancy of which refined to 0.54 (3). In H(2)O (or D(2)O), the title complex hydrolyses to Ca(2+) (aq) cations and [Co(3)(ida)(3)(μ(2)-OH)(3)(μ(3)-O)](2−) anions. International Union of Crystallography 2010-03-31 /pmc/articles/PMC2984083/ /pubmed/21580563 http://dx.doi.org/10.1107/S1600536810010998 Text en © Ama et al. 2010 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
Ama, Tomoharu
Yonemura, Toshiaki
Morita, Shogo
Yamaguchi, Masanori
Penta­aqua­tri-μ(3)-hydroxido-tris­(imino­diacetato)-μ(3)-oxido-tetra­hedro-calcium(II)tricobalt(III) 2.54-hydrate
title Penta­aqua­tri-μ(3)-hydroxido-tris­(imino­diacetato)-μ(3)-oxido-tetra­hedro-calcium(II)tricobalt(III) 2.54-hydrate
title_full Penta­aqua­tri-μ(3)-hydroxido-tris­(imino­diacetato)-μ(3)-oxido-tetra­hedro-calcium(II)tricobalt(III) 2.54-hydrate
title_fullStr Penta­aqua­tri-μ(3)-hydroxido-tris­(imino­diacetato)-μ(3)-oxido-tetra­hedro-calcium(II)tricobalt(III) 2.54-hydrate
title_full_unstemmed Penta­aqua­tri-μ(3)-hydroxido-tris­(imino­diacetato)-μ(3)-oxido-tetra­hedro-calcium(II)tricobalt(III) 2.54-hydrate
title_short Penta­aqua­tri-μ(3)-hydroxido-tris­(imino­diacetato)-μ(3)-oxido-tetra­hedro-calcium(II)tricobalt(III) 2.54-hydrate
title_sort penta­aqua­tri-μ(3)-hydroxido-tris­(imino­diacetato)-μ(3)-oxido-tetra­hedro-calcium(ii)tricobalt(iii) 2.54-hydrate
topic Metal-Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2984083/
https://www.ncbi.nlm.nih.gov/pubmed/21580563
http://dx.doi.org/10.1107/S1600536810010998
work_keys_str_mv AT amatomoharu pentaaquatrim3hydroxidotrisiminodiacetatom3oxidotetrahedrocalciumiitricobaltiii254hydrate
AT yonemuratoshiaki pentaaquatrim3hydroxidotrisiminodiacetatom3oxidotetrahedrocalciumiitricobaltiii254hydrate
AT moritashogo pentaaquatrim3hydroxidotrisiminodiacetatom3oxidotetrahedrocalciumiitricobaltiii254hydrate
AT yamaguchimasanori pentaaquatrim3hydroxidotrisiminodiacetatom3oxidotetrahedrocalciumiitricobaltiii254hydrate