Crystallography Open Database

Information card for entry 7226092

Preview

Coordinates	7226092.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H14 Mn2 N4 O9
Calculated formula	C22 H12 Mn2 N4 O9
Title of publication	Structural diversity, luminescence and photocatalytic properties of six coordination polymers based on designed bifunctional 2-(imidazol-1-yl)terephthalic acid
Authors of publication	Zhang, Xiutang; Fan, Liming; Fan, Weiliu; Li, Bin; Liu, Guangzeng; Liu, Xinzheng; Zhao, Xian
Journal of publication	CrystEngComm
Year of publication	2016
Journal volume	18
Journal issue	36
Pages of publication	6914
a	17.3409 ± 0.0006 Å
b	7.7719 ± 0.0003 Å
c	15.5112 ± 0.0006 Å
α	90°
β	90°
γ	90°
Cell volume	2090.47 ± 0.14 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	60
Hermann-Mauguin space group symbol	P b c n
Hall space group symbol	-P 2n 2ab
Residual factor for all reflections	0.054
Residual factor for significantly intense reflections	0.0531
Weighted residual factors for significantly intense reflections	0.1665
Weighted residual factors for all reflections included in the refinement	0.1679
Goodness-of-fit parameter for all reflections included in the refinement	1.116
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
187041 (current)	2016-10-08	cif/ Updating files of 7226091, 7226092, 7226093, 7226094, 7226095, 7226096 Original log message: Adding full bibliography for 7226091--7226096.cif.	7226092.cif
184770	2016-08-02	cif/ Adding structures of 7226091, 7226092, 7226093, 7226094, 7226095, 7226096 via cif-deposit CGI script.	7226092.cif