Crystallography Open Database

Information card for entry 4129838

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Coordinates	4129838.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C407 H569 Cu24 N50 O201
Calculated formula	C224 H200 Cu24 N8 O144
Title of publication	Coordination-Driven Polymerization of Supramolecular Nanocages.
Authors of publication	Niu, Zheng; Fang, Sheng; Liu, Xiao; Ma, Jian-Gong; Ma, Shengqian; Cheng, Peng
Journal of publication	Journal of the American Chemical Society
Year of publication	2015
Journal volume	137
Journal issue	47
Pages of publication	14873 - 14876
a	26.5211 ± 0.0007 Å
b	26.5211 ± 0.0007 Å
c	39.0679 ± 0.0016 Å
α	90°
β	90°
γ	90°
Cell volume	27479.1 ± 1.5 Å³
Cell temperature	128.9 ± 0.3 K
Ambient diffraction temperature	128.9 ± 0.3 K
Number of distinct elements	5
Space group number	87
Hermann-Mauguin space group symbol	I 4/m
Hall space group symbol	-I 4
Residual factor for all reflections	0.0966
Residual factor for significantly intense reflections	0.0671
Weighted residual factors for significantly intense reflections	0.1853
Weighted residual factors for all reflections included in the refinement	0.1991
Goodness-of-fit parameter for all reflections included in the refinement	0.944
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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