Crystallography Open Database

Information card for entry 8105775

Preview

Coordinates	8105775.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H14 Cu N4 O6 S
Calculated formula	C18 H14 Cu N4 O6 S
Title of publication	Crystal structure of poly-[(μ2(carboxylatomethyl)((3-nitrophenyl)sulfonyl)amido-κ3 N: O:O′)(μ2-4,4′-bipyridine-κ2 N:N′)copper(II)], C18H14CuN4O6S
Authors of publication	Liu, Zheng-Jun; Chen, Xiao-Miao; Cheng, Jing-Song; Deng, Tao-Li; Qin, Lan
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2019
Journal volume	234
Journal issue	3
Pages of publication	547 - 548
a	31.125 ± 0.003 Å
b	31.125 ± 0.003 Å
c	10.133 ± 0.002 Å
α	90°
β	90°
γ	120°
Cell volume	8501 ± 2 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296.15 K
Number of distinct elements	6
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Residual factor for all reflections	0.0494
Residual factor for significantly intense reflections	0.0346
Weighted residual factors for significantly intense reflections	0.0839
Weighted residual factors for all reflections included in the refinement	0.09
Goodness-of-fit parameter for all reflections included in the refinement	1.043
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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