Crystallography Open Database

Information card for entry 8103263

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Coordinates	8103263.cif

Structure parameters

Formula	H104 Mo2 N6 O122 W24 Zn
Calculated formula	H104.16 Mo2 N6 O122 W24 Zn
Title of publication	Crystal structure of diammonium hexaaquazinc(II) bis[(?12-molybdato)-tetracosa(?2-oxo)-dodecaoxo-dodecatungsten] — ammonia — water (1:4:36), [NH4]2[Zn(H2O)6][(MoW12O40)2] • 4NH3 • 36H2O
Authors of publication	Hai-Xing Liu
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2011
Journal volume	226
Journal issue	4
Pages of publication	441
a	22.54 ± 0.002 Å
b	22.54 ± 0.002 Å
c	22.54 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	11451.5 ± 1.8 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	6
Space group number	225
Hermann-Mauguin space group symbol	F m -3 m
Hall space group symbol	-F 4 2 3
Residual factor for all reflections	0.0513
Residual factor for significantly intense reflections	0.041
Weighted residual factors for significantly intense reflections	0.1147
Weighted residual factors for all reflections included in the refinement	0.1264
Goodness-of-fit parameter for all reflections included in the refinement	1.314
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.	8103263.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.	8103263.cif
35911	2012-02-28	cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree.	8103263.cif
32605	2012-02-09	../uploads/cif-deposit/cod/cif Adding structures of 8103263 via cif-deposit CGI script.	8103263.cif