Crystallography Open Database

Information card for entry 7205194

7205193 << 7205194 >> 7205195

Preview

Coordinates	7205194.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H24 Cu N6 O10 S
Calculated formula	C14 H24 Cu N6 O10 S
Title of publication	Coordination polymers derived from a flexible bis(pyridylurea) ligand: conformational change of the ligand and structural diversity of the complexes
Authors of publication	Hao, Yongjing; Wu, Biao; Li, Shaoguang; Jia, Chuandong; Huang, Xiaojuan; Yang, Xiao-Juan
Journal of publication	CrystEngComm
Year of publication	2011
Journal volume	13
Journal issue	1
Pages of publication	215
a	18.861 ± 0.005 Å
b	16.141 ± 0.004 Å
c	13.487 ± 0.004 Å
α	90°
β	90°
γ	90°
Cell volume	4105.9 ± 1.9 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	52
Hermann-Mauguin space group symbol	P n n a
Hall space group symbol	-P 2a 2bc
Residual factor for all reflections	0.0986
Residual factor for significantly intense reflections	0.0486
Weighted residual factors for significantly intense reflections	0.119
Weighted residual factors for all reflections included in the refinement	0.1405
Goodness-of-fit parameter for all reflections included in the refinement	1.045
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
180382 (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 7/20/51.	7205194.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7205194.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7205194.cif
14570	2011-03-11	../uploads/cif-deposit/cod/cif Adding structures of 7205194, 7205195, 7205196, 7205197, 7205198 via cif-deposit CGI script.	7205194.cif