Crystallography Open Database

Information card for entry 7205706

7205705 << 7205706 >> 7205707

Preview

Coordinates	7205706.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27 H35 Cu4 I4 O S3
Calculated formula	C27 H34.98 Cu4 I4 O S3
Title of publication	Cuprous iodide coordination polymers (CuI)x(L)y·z(solvent) built on linear thioether linkers
Authors of publication	Zhang, Jun; Xue, Yun-Shan; Li, Yi-Zhi; Du, Hong-Bin; You, Xiao-Zeng
Journal of publication	CrystEngComm
Year of publication	2011
Journal volume	13
Journal issue	7
Pages of publication	2578
a	16.665 ± 0.0005 Å
b	16.665 ± 0.0005 Å
c	57.781 ± 0.008 Å
α	90°
β	90°
γ	120°
Cell volume	13897 ± 2 Å³
Cell temperature	291 ± 2 K
Ambient diffraction temperature	291 ± 2 K
Number of distinct elements	6
Space group number	167
Hermann-Mauguin space group symbol	R -3 c :H
Hall space group symbol	-R 3 2"c
Residual factor for all reflections	0.0775
Residual factor for significantly intense reflections	0.0481
Weighted residual factors for significantly intense reflections	0.1161
Weighted residual factors for all reflections included in the refinement	0.1226
Goodness-of-fit parameter for all reflections included in the refinement	1.005
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
180388 (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 7/20/57.	7205706.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7205706.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7205706.cif
20993	2011-06-21	../uploads/cif-deposit/cod/cif Adding structures of 7205703, 7205704, 7205705, 7205706 via cif-deposit CGI script.	7205706.cif