Crystallography Open Database

Information card for entry 7205201

7205200 << 7205201 >> 7205202

Preview

Coordinates	7205201.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H30 Cu2 N12 O9
Calculated formula	C36 H30 Cu2 N12 O9
Title of publication	Syntheses, structures, photoluminescence and magnetic properties of four new metal‒organic frameworks based on imidazole ligands and aromatic polycarboxylate acids
Authors of publication	Xu, Jiao; Yao, Xiao-Qiang; Huang, Liang-Fang; Li, Yi-Zhi; Zheng, He-Gen
Journal of publication	CrystEngComm
Year of publication	2011
Journal volume	13
Journal issue	3
Pages of publication	857
a	17.559 ± 0.003 Å
b	11.426 ± 0.002 Å
c	21.736 ± 0.003 Å
α	90°
β	114.588 ± 0.011°
γ	90°
Cell volume	3965.4 ± 1.2 Å³
Cell temperature	291 ± 2 K
Ambient diffraction temperature	291 ± 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	0.0966
Residual factor for significantly intense reflections	0.0586
Weighted residual factors for significantly intense reflections	0.1319
Weighted residual factors for all reflections included in the refinement	0.1417
Goodness-of-fit parameter for all reflections included in the refinement	1.034
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
180383 (current)	2016-03-26	cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/52.	7205201.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7205201.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7205201.cif
14572	2011-03-11	../uploads/cif-deposit/cod/cif Adding structures of 7205201, 7205202, 7205203, 7205204 via cif-deposit CGI script.	7205201.cif