Crystallography Open Database

Information card for entry 7227013

Preview

Coordinates	7227013.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H32 Cu N4 O8
Calculated formula	C28 H32 Cu N4 O8
Title of publication	A series of bis(pyridyl)-bis(amide)-modulated metal-1,2-phenylenediacetate coordination polymers: construction and selective dye adsorption
Authors of publication	Wang, Xiuli; Zhao, Jing; Le, Mao; Lin, Hongyan; Liu, Guocheng; Wang, Xiang
Journal of publication	CrystEngComm
Year of publication	2016
Journal volume	18
Journal issue	48
Pages of publication	9316
a	9.0062 ± 0.0006 Å
b	19.4623 ± 0.0014 Å
c	16.0701 ± 0.0012 Å
α	90°
β	94.442 ± 0.001°
γ	90°
Cell volume	2808.3 ± 0.3 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	0.084
Residual factor for significantly intense reflections	0.0509
Weighted residual factors for significantly intense reflections	0.116
Weighted residual factors for all reflections included in the refinement	0.1306
Goodness-of-fit parameter for all reflections included in the refinement	1.02
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
190079 (current)	2017-01-09	cif/ Updating files of 7227012, 7227013, 7227014, 7227015, 7227016 Original log message: Adding full bibliography for 7227012--7227016.cif.	7227013.cif
188024	2016-11-08	cif/ Adding structures of 7227012, 7227013, 7227014, 7227015, 7227016 via cif-deposit CGI script.	7227013.cif