Crystallography Open Database

Information card for entry 7230304

Preview

Coordinates	7230304.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H34 Cu3 N6 O10
Calculated formula	C24 H22 Cu3 N4 O10
Title of publication	A water stable microporous metal‒organic framework based on rod SBUs: synthesis, structure and adsorption properties
Authors of publication	Yuan, Jiaqi; Mu, Li; Li, Jiantang; Zhang, Lirong; Li, Guanghua; Huo, Qisheng; Liu, Yunling
Journal of publication	CrystEngComm
Year of publication	2018
Journal volume	20
Journal issue	15
Pages of publication	2169
a	15.225 ± 0.003 Å
b	19.518 ± 0.004 Å
c	10.927 ± 0.002 Å
α	90°
β	93.42 ± 0.03°
γ	90°
Cell volume	3241.3 ± 1.1 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0217
Residual factor for significantly intense reflections	0.0192
Weighted residual factors for significantly intense reflections	0.0522
Weighted residual factors for all reflections included in the refinement	0.053
Goodness-of-fit parameter for all reflections included in the refinement	1.088
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
229096 (current)	2019-11-17	cif/ Updating files of 7230304 Original log message: Adding full bibliography for 7230304.cif.	7230304.cif
206992	2018-03-17	cif/ Adding structures of 7230304 via cif-deposit CGI script.	7230304.cif