Crystallography Open Database

Information card for entry 4119800

4119799 << 4119800 >> 4119801

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Structure parameters

Formula	C30 O17 S6 Zn4
Calculated formula	C30 O17 S6 Zn4
Title of publication	Convenient Detection of Pd(II) by a Metal-Organic Framework with Sulfur and Olefin Functions
Authors of publication	Jun He; Meiqin Zha; Jieshun Cui; Matthias Zeller; Allen D. Hunter; Shek-Man Yiu; Shuit-Tong Lee; Zhengtao Xu
Journal of publication	Journal of the American Chemical Society
Year of publication	2013
Journal volume	135
Pages of publication	7807 - 7810
a	25.326 ± 0.003 Å
b	25.326 ± 0.003 Å
c	25.326 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	16244 ± 3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	4
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	0.3137
Residual factor for significantly intense reflections	0.2257
Weighted residual factors for significantly intense reflections	0.5503
Weighted residual factors for all reflections included in the refinement	0.5959
Goodness-of-fit parameter for all reflections included in the refinement	1.929
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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