Crystallography Open Database

Information card for entry 4330850

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Coordinates	4330850.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C96 H0 Cu2 N6 O73 Si2 W20
Calculated formula	C96 Cu2 N6 O73 Si2 W20
Title of publication	Synthesis and Reversible Transformation of Cun-Bridged (n= 1, 2, or 4) Silicodecatungstate Dimers
Authors of publication	Kosuke Suzuki; Masahiro Shinoe; Noritaka Mizuno
Journal of publication	Inorganic Chemistry
Year of publication	2012
Journal volume	51
Pages of publication	11574 - 11581
a	18.1007 ± 0.0002 Å
b	26.6281 ± 0.0003 Å
c	22.7005 ± 0.0003 Å
α	90°
β	89.971 ± 0.001°
γ	90°
Cell volume	10941.4 ± 0.2 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153 ± 2 K
Number of distinct elements	7
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.1012
Residual factor for significantly intense reflections	0.0707
Weighted residual factors for significantly intense reflections	0.1822
Weighted residual factors for all reflections included in the refinement	0.2077
Goodness-of-fit parameter for all reflections included in the refinement	1.103
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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