Crystallography Open Database

Information card for entry 7233405

Preview

Coordinates	7233405.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C72 H90 N6 O31 Zn7
Calculated formula	C72 H72 N6 O31 Zn7
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	43.6114 ± 0.0018 Å
b	43.6114 ± 0.0018 Å
c	43.6114 ± 0.0018 Å
α	90°
β	90°
γ	90°
Cell volume	82947 ± 6 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	225
Hermann-Mauguin space group symbol	F m -3 m
Hall space group symbol	-F 4 2 3
Residual factor for all reflections	0.2533
Residual factor for significantly intense reflections	0.1448
Weighted residual factors for significantly intense reflections	0.3452
Weighted residual factors for all reflections included in the refinement	0.4833
Goodness-of-fit parameter for all reflections included in the refinement	1.688
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.	7233405.cif
217626	2019-08-21	cif/ Adding structures of 7233404, 7233405 via cif-deposit CGI script.	7233405.cif