Crystallography Open Database

Information card for entry 4308136

Preview

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

Version history

Revision	Date	Message	Files
179119 (current)	2016-03-23	cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/81.	4308136.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4308136.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4308136.cif
1194	2010-06-06	cif/4/ Adding data from Inorg-Chem-2007_01-13/ processing directory.	4308136.cif