Crystallography Open Database

Information card for entry 7239871

Preview

Coordinates	7239871.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C11 H11 Cd N2 O5
Calculated formula	C11 H9 Cd N O6
Title of publication	A series of anionic MOFs with cluster-based, pillared-layer and rod-spacer motifs: near-sunlight white-light emission and selective dye capture
Authors of publication	Wang, Ce; Yin, Zheng; Cheng, Zhao; Ma, Wei-Min; Li, Xi-Yao; Hu, Xiao-Ting; Shi, Rong; Chen, Ao-Wei; Ma, Yang-Min
Journal of publication	CrystEngComm
Year of publication	2020
Journal volume	22
Journal issue	5
Pages of publication	878 - 887
a	12.5634 ± 0.0003 Å
b	16.1618 ± 0.0003 Å
c	17.1222 ± 0.0003 Å
α	90°
β	90°
γ	90°
Cell volume	3476.61 ± 0.12 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.0452
Residual factor for significantly intense reflections	0.041
Weighted residual factors for significantly intense reflections	0.1205
Weighted residual factors for all reflections included in the refinement	0.137
Goodness-of-fit parameter for all reflections included in the refinement	1.126
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
257446 (current)	2020-10-06	cif/ Updating files of 7239868, 7239869, 7239870, 7239871, 7239872 Original log message: Adding full bibliography for 7239868--7239872.cif.	7239871.cif
247550	2020-02-04	cif/ Adding structures of 7239868, 7239869, 7239870, 7239871, 7239872 via cif-deposit CGI script.	7239871.cif