Crystallography Open Database

Information card for entry 4502357

Preview

Coordinates	4502357.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C56 H66 Cl2 Cu6 N14 S6
Calculated formula	C56 H66 Cl2 Cu6 N14 S6
Title of publication	A Series of Polynuclear Complexes of d10Metals With Interesting Luminescent Properties
Authors of publication	Chen, Shan-Ci; Yu, Rong-Min; Zhao, Zhen-Guo; Chen, Shu-Mei; Zhang, Qi-Sheng; Wu, Xiao-Yuan; Wang, Fei; Lu, Can-Zhong
Journal of publication	Crystal Growth & Design
Year of publication	2010
Journal volume	10
Journal issue	3
Pages of publication	1155
a	18.7167 ± 0.0004 Å
b	18.7167 ± 0.0004 Å
c	18.7167 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	6556.7 ± 0.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	205
Hermann-Mauguin space group symbol	P a -3
Hall space group symbol	-P 2ac 2ab 3
Residual factor for all reflections	0.0898
Residual factor for significantly intense reflections	0.0797
Weighted residual factors for significantly intense reflections	0.2381
Weighted residual factors for all reflections included in the refinement	0.2489
Goodness-of-fit parameter for all reflections included in the refinement	1.197
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
179554 (current)	2016-03-24	cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/23.	4502357.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4502357.cif
36367	2012-03-01	../uploads/cif-deposit/cod/cif Adding structures of 4502357 via cif-deposit CGI script.	4502357.cif