Crystallography Open Database

Information card for entry 7217722

Preview

Coordinates	7217722.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 O13 Zn4
Calculated formula	C24 O13 Zn4
Title of publication	Post-synthetic pore-space expansion in a di-tagged metal‒organic framework
Authors of publication	Tshering, Lodey; Hunter, Sally O.; Nikolich, Alexandra; Minato, Erica; Fitchett, Christopher M.; D'Alessandro, Deanna M.; Richardson, Christopher
Journal of publication	CrystEngComm
Year of publication	2014
Journal volume	16
Journal issue	39
Pages of publication	9158
a	12.7953 ± 0.001 Å
b	12.7953 ± 0.001 Å
c	12.7953 ± 0.001 Å
α	90°
β	90°
γ	90°
Cell volume	2094.8 ± 0.3 Å³
Cell temperature	290.81 ± 0.1 K
Ambient diffraction temperature	290.81 ± 0.1 K
Number of distinct elements	3
Space group number	221
Hermann-Mauguin space group symbol	P m -3 m
Hall space group symbol	-P 4 2 3
Residual factor for all reflections	0.2189
Residual factor for significantly intense reflections	0.1982
Weighted residual factors for significantly intense reflections	0.5018
Weighted residual factors for all reflections included in the refinement	0.5309
Goodness-of-fit parameter for all reflections included in the refinement	2.242
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
180508 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/77.	7217722.cif
124681	2014-10-06	cif/ Updating files of 7217722, 7217723 Original log message: Adding full bibliography for 7217722--7217723.cif.	7217722.cif
121920	2014-08-14	cif/ Adding structures of 7217722, 7217723 via cif-deposit CGI script.	7217722.cif