Crystallography Open Database

Information card for entry 2020827

2020826 << 2020827 >> 2020828

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Structure parameters

Chemical name	Poly[[(μ-4,4'-bipyridine-κ^2^<i>N</i>,<i>N</i>')(μ-2,4'-oxydibenzoato-κ^4^<i>O</i>^2^,<i>O</i>^2'^:<i>O</i>^4^,<i>O</i>^4'^)copper(II)] monohydrate]{[Cu(C~14~H~8~O~5~)(C~10~H~8~N~2~)]\χdotH~2~O
Formula	C24 H18 Cu N2 O6
Calculated formula	C24 H18 Cu N2 O6
Title of publication	A two-dimensional copper(II) coordination polymer based on 2,4′-oxybis(benzoate) and 4,4′-bipyridine
Authors of publication	Tang, Long; Zhang, Juan; Liu, Xiao-Xia; Wang, Ji-Jiang; Fu, Feng
Journal of publication	Acta Crystallographica Section C Structural Chemistry
Year of publication	2017
Journal volume	73
Journal issue	7
a	11.731 ± 0.004 Å
b	14.274 ± 0.005 Å
c	13.211 ± 0.005 Å
α	90°
β	100.862 ± 0.007°
γ	90°
Cell volume	2172.5 ± 1.3 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 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	0.0743
Residual factor for significantly intense reflections	0.0419
Weighted residual factors for significantly intense reflections	0.1007
Weighted residual factors for all reflections included in the refinement	0.1094
Goodness-of-fit parameter for all reflections included in the refinement	1.005
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	Yes

Version history

Revision	Date	Message	Files
199104 (current)	2017-07-25	cif/ hkl/ Adding structures of 2020827 via cif-deposit CGI script.	2020827.cif 2020827.hkl