Crystallography Open Database

Information card for entry 8102987

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Coordinates	8102987.cif

Structure parameters

Formula	H50 Na2 O62 W12
Calculated formula	H50 Na2 O62 W12
Title of publication	Crystal structure of hexakis(m3-hydroxo)-tetra(m2-hydroxo)-octadeca(m2-oxo)-tetradecaoxo-disodium(I) dodecatungsten dodecahydrate, [Na(H2O)4]2(H10W12O42) · 12H2O
Authors of publication	Bi-Song Zhang
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2008
Journal volume	223
Journal issue	4
Pages of publication	317
a	14.105 ± 0.003 Å
b	15.729 ± 0.003 Å
c	22.892 ± 0.005 Å
α	90°
β	90°
γ	90°
Cell volume	5078.8 ± 1.8 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0549
Residual factor for significantly intense reflections	0.0439
Weighted residual factors for significantly intense reflections	0.1027
Weighted residual factors for all reflections included in the refinement	0.107
Goodness-of-fit parameter for all reflections included in the refinement	1.065
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
211175 (current)	2018-09-26	cif/ Removing _chemical_name_systematic and _chemical_name_common data items with placeholder values from 513 entries in range 8.	8102987.cif
176728	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 8.	8102987.cif
35911	2012-02-28	cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree.	8102987.cif
13726	2011-03-06	../uploads/cif-deposit/cod/cif Adding structures of 8102987 via cif-deposit CGI script.	8102987.cif