Crystallography Open Database

Information card for entry 4308136

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Coordinates	4308136.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 N3 O18 W3
Calculated formula	C48.06 N3 O18.015 W2.9991
Title of publication	μ-η1:η1-Peroxo-Bridged Dinuclear Peroxotungstate Catalytically Active for Epoxidation of Olefins
Authors of publication	Keigo Kamata; Shinjiro Kuzuya; Kazuhiro Uehara; Syuhei Yamaguchi; Noritaka Mizuno
Journal of publication	Inorganic Chemistry
Year of publication	2007
Journal volume	46
Pages of publication	3768 - 3774
a	34.5727 ± 0.0003 Å
b	14.2882 ± 0.0002 Å
c	30.4695 ± 0.0004 Å
α	90°
β	121.656 ± 0.001°
γ	90°
Cell volume	12811.9 ± 0.3 Å³
Cell temperature	153 ± 2 K
Number of distinct elements	4
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for significantly intense reflections	0.062
Weighted residual factors for all reflections included in the refinement	0.211
Goodness-of-fit parameter for all reflections included in the refinement	1.063
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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