Crystallography Open Database

Information card for entry 7221765

Preview

Coordinates	7221765.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C31 H41 Cd N5 O14
Calculated formula	C31 H41 Cd N5 O14
Title of publication	Two Luminescent Metal-Organic Frameworks with Multifunctional Properties for Nitroaromatic Compounds Sensing and Photocatalysis
Authors of publication	Wang, Fengqin; Wang, Chengmiao; Yu, Zongchao; He, Qingguo; Li, Xiuyu; Shang, Chonglong; Zhao, Yongnan
Journal of publication	RSC Adv.
Year of publication	2015
a	10.184 ± 0.002 Å
b	10.348 ± 0.002 Å
c	18.091 ± 0.004 Å
α	102.34 ± 0.03°
β	99.19 ± 0.03°
γ	93.95 ± 0.03°
Cell volume	1828 ± 0.7 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0527
Residual factor for significantly intense reflections	0.0416
Weighted residual factors for significantly intense reflections	0.1049
Weighted residual factors for all reflections included in the refinement	0.1123
Goodness-of-fit parameter for all reflections included in the refinement	1.021
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
176428 (current)	2016-02-13	Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively.	7221765.cif
153335	2015-08-11	cif/ Adding structures of 7221765, 7221766 via cif-deposit CGI script.	7221765.cif