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Crystal structure of trirubidium citrate from laboratory X-ray powder diffraction data and DFT comparison

The crystal structure of trirubidium citrate, 3Rb(+)·C(6)H(5)O(7) (3−), has been solved and refined using laboratory X-ray powder diffraction data, and optimized using density functional techniques. The two independent Rb(+) cations are seven- and eight-coordinate, with bond-valence sums of 0.99 and...

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Detalhes bibliográficos
Publicado no:Acta Crystallogr E Crystallogr Commun
Main Authors: Rammohan, Alagappa, Kaduk, James A.
Formato: Artigo
Idioma:Inglês
Publicado em: International Union of Crystallography 2017
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC5290576/
https://ncbi.nlm.nih.gov/pubmed/28217353
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1107/S2056989017001086
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