Crystallography Open Database

Information card for entry 2021729

2021728 << 2021729 >> 2021730

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Structure parameters

Chemical name	Poly[{μ~6~-1,1'-[1,4-phenylenebis(methylene)]bis(3,5-dicarboxylatopyridinium)}cadmium(II)]
Formula	C22 H14 Cd N2 O8
Calculated formula	C22 H14 Cd N2 O8
Title of publication	Effect of pH on the construction of Cd^II^ coordination polymers involving the 1,1'-[1,4-phenylenebis(methylene)]bis(3,5-dicarboxylatopyridinium) ligand
Authors of publication	Shao, Zhi-Chao; Meng, Xiang-Ru; Hou, Hong-Wei
Journal of publication	Acta Crystallographica Section C
Year of publication	2019
Journal volume	75
Journal issue	8
a	4.6802 ± 0.0007 Å
b	15.507 ± 0.002 Å
c	12.8345 ± 0.0017 Å
α	90°
β	93.757 ± 0.005°
γ	90°
Cell volume	929.5 ± 0.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.06
Residual factor for significantly intense reflections	0.0398
Weighted residual factors for significantly intense reflections	0.0999
Weighted residual factors for all reflections included in the refinement	0.108
Goodness-of-fit parameter for all reflections included in the refinement	1.066
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

Version history

Revision	Date	Message	Files
217273 (current)	2019-07-26	cif/ hkl/ Adding structures of 2021728, 2021729 via cif-deposit CGI script.	2021729.cif 2021729.hkl