Crystallography Open Database

Information card for entry 1547233

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Coordinates	1547233.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C60 H39 N9 O15 Zn3
Calculated formula	C60 H39 N9 O15 Zn3
Title of publication	A functionalized metal-organic framework decorated with O− groups showing excellent performance for lead(II) removal from aqueous solution
Authors of publication	Hou, Hongwei; Yu, Cai-Xia; Shao, Chao Zhi
Journal of publication	Chem. Sci.
Year of publication	2017
a	19.604 ± 0.004 Å
b	28.079 ± 0.006 Å
c	32.67 ± 0.007 Å
α	90°
β	94.47 ± 0.03°
γ	90°
Cell volume	17929 ± 7 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0847
Residual factor for significantly intense reflections	0.0623
Weighted residual factors for significantly intense reflections	0.1772
Weighted residual factors for all reflections included in the refinement	0.1871
Goodness-of-fit parameter for all reflections included in the refinement	1.093
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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