Crystallography Open Database

Information card for entry 7232078

7232077 << 7232078 >> 7232079

Preview

Coordinates	7232078.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H38 Cd3 N6 O17
Calculated formula	C48 H38 Cd3 N6 O17
Title of publication	A stable anionic metal‒organic framework with open coordinated sites: selective separation toward cationic dyes and sensing properties
Authors of publication	Gao, Wei; Liu, Feng; Pan, Chang-Wei; Zhang, Xiu-Mei; Liu, Jie-Ping; Gao, Qing-Yu
Journal of publication	CrystEngComm
Year of publication	2019
Journal volume	21
Journal issue	7
Pages of publication	1159
a	17.96 ± 0.004 Å
b	12.903 ± 0.002 Å
c	24.414 ± 0.004 Å
α	90°
β	127.047 ± 0.011°
γ	90°
Cell volume	4515.6 ± 1.6 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	0.0883
Residual factor for significantly intense reflections	0.0453
Weighted residual factors for significantly intense reflections	0.0893
Weighted residual factors for all reflections included in the refinement	0.1056
Goodness-of-fit parameter for all reflections included in the refinement	1.012
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
223655 (current)	2019-11-07	cif/ Updating files of 7232078 Original log message: Adding full bibliography for 7232078.cif.	7232078.cif
212921	2019-01-11	cif/ Adding structures of 7232078 via cif-deposit CGI script.	7232078.cif