Crystallography Open Database

Information card for entry 4305263

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Coordinates	4305263.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C52 H52 N10 Ni2 O70 P2 W18
Calculated formula	C52 H42 N10 Ni2 O71 P2 W18
Title of publication	Two Dawson-Templated Three-Dimensional Metal-Organic Frameworks Based on Oxalate-Bridged Binuclear Cobalt(II)/Nickel(II) SBUs and Bpy Linkers
Authors of publication	Xinyu Zhao; Dadong Liang; Shuxia Liu; Chunyan Sun; Ruige Cao; Chaoying Gao; Yuanhang Ren; Zhongmin Su
Journal of publication	Inorganic Chemistry
Year of publication	2008
Journal volume	47
Pages of publication	7133 - 7138
a	15.0721 ± 0.0009 Å
b	24.7694 ± 0.0014 Å
c	15.1707 ± 0.0009 Å
α	90°
β	110.541 ± 0.001°
γ	90°
Cell volume	5303.5 ± 0.5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	11
Hermann-Mauguin space group symbol	P 1 21/m 1
Hall space group symbol	-P 2yb
Residual factor for all reflections	0.0827
Residual factor for significantly intense reflections	0.0453
Weighted residual factors for significantly intense reflections	0.1036
Weighted residual factors for all reflections included in the refinement	0.114
Goodness-of-fit parameter for all reflections included in the refinement	1.005
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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