Crystallography Open Database

Information card for entry 4335718

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Coordinates	4335718.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C74 H48 Cu2 N17 O24
Calculated formula	C74 H48 Cu2 N17 O24
Title of publication	A Trigonal Prismatic Ligand in the Metal-Mediated Self-Assembly of One- and Two-Dimensional Metallosupramolecular Polymers
Authors of publication	Wen-Jing Hu; Long-Qing Liu; Ming-Liang Ma; Xiao-Li Zhao; Yahu A. Liu; Xian-Qiang Mi; Biao Jiang; Ke Wen
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	9309 - 9319
a	14.2224 ± 0.0007 Å
b	19.3544 ± 0.0009 Å
c	27.9524 ± 0.0011 Å
α	90°
β	110.187 ± 0.002°
γ	90°
Cell volume	7221.7 ± 0.6 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0651
Residual factor for significantly intense reflections	0.0487
Weighted residual factors for significantly intense reflections	0.1187
Weighted residual factors for all reflections included in the refinement	0.1331
Goodness-of-fit parameter for all reflections included in the refinement	1.026
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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