Crystallography Open Database

Information card for entry 7233404

Preview

Coordinates	7233404.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C109 H147 Cd4 N19 Na2 O35
Calculated formula	C109 H147 Cd4 N19 Na2 O35
Title of publication	Luminescent metal organic frameworks for sensing and gas adsorption studies
Authors of publication	Verma, Pankaj; Singh, Udai P.; Butcher, Ray J.
Journal of publication	CrystEngComm
Year of publication	2019
Journal volume	21
Journal issue	36
Pages of publication	5470
a	16.836 ± 0.0014 Å
b	24.094 ± 0.002 Å
c	17.7653 ± 0.0015 Å
α	90°
β	117.791 ± 0.003°
γ	90°
Cell volume	6375.2 ± 0.9 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296.15 K
Number of distinct elements	6
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	0.1197
Residual factor for significantly intense reflections	0.0692
Weighted residual factors for significantly intense reflections	0.1883
Weighted residual factors for all reflections included in the refinement	0.2216
Goodness-of-fit parameter for all reflections included in the refinement	1.045
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
223695 (current)	2019-11-07	cif/ Updating files of 7233404, 7233405 Original log message: Adding full bibliography for 7233404--7233405.cif.	7233404.cif
217626	2019-08-21	cif/ Adding structures of 7233404, 7233405 via cif-deposit CGI script.	7233404.cif