Crystallography Open Database

Information card for entry 7222027

7222026 << 7222027 >> 7222028

Preview

Coordinates	7222027.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C33 H29 Cd N5 O8 S
Calculated formula	C33 H27 Cd N5 O8 S
Title of publication	A series of entangled coordination polymers assembled by a V-shaped bisimidazole ligand and various dicarboxylic acids: synthesis, characterization and luminescence properties
Authors of publication	Guo, Huadong; Yan, Yongnian; Wang, Nan; Guo, Xianmin; Zheng, Guoli; Qi, Yanjuan
Journal of publication	CrystEngComm
Year of publication	2015
Journal volume	17
Journal issue	34
Pages of publication	6512
a	10.8259 ± 0.0006 Å
b	19.6449 ± 0.001 Å
c	16.287 ± 0.0009 Å
α	90°
β	90.987 ± 0.001°
γ	90°
Cell volume	3463.3 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0628
Residual factor for significantly intense reflections	0.04
Weighted residual factors for significantly intense reflections	0.1065
Weighted residual factors for all reflections included in the refinement	0.122
Goodness-of-fit parameter for all reflections included in the refinement	1.064
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
176428 (current)	2016-02-13	Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively.	7222027.cif
155090	2015-09-07	cif/ Adding structures of 7222019, 7222020, 7222021, 7222022, 7222023, 7222024, 7222025, 7222026, 7222027 via cif-deposit CGI script.	7222027.cif