Crystallography Open Database

Information card for entry 4335721

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Coordinates	4335721.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H28 Cl2 Cu N6 O8
Calculated formula	C32 H28 Cl2 Cu N6 O8
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	14.4555 ± 0.0003 Å
b	18.4604 ± 0.0004 Å
c	13.0973 ± 0.0005 Å
α	90°
β	112.328 ± 0.001°
γ	90°
Cell volume	3233.03 ± 0.16 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
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	0.0475
Residual factor for significantly intense reflections	0.0421
Weighted residual factors for significantly intense reflections	0.1116
Weighted residual factors for all reflections included in the refinement	0.1169
Goodness-of-fit parameter for all reflections included in the refinement	1.06
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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