Crystallography Open Database

Information card for entry 4307093

Preview

Coordinates	4307093.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H16 Cu4 I4 N4 S2
Calculated formula	C20 H16 Cu4 I4 N4 S2
Title of publication	New In Situ Cleavage of Both S-S and S-C(sp2) Bonds and Rearrangement Reactions toward the Construction of Copper(I) Cluster-Based Coordination Networks
Authors of publication	Jing Wang; Shao-Liang Zheng; Sheng Hu; Yue-Hua Zhang; Ming-Liang Tong
Journal of publication	Inorganic Chemistry
Year of publication	2007
Journal volume	46
Pages of publication	795 - 800
a	8.0037 ± 0.0011 Å
b	10.3851 ± 0.0013 Å
c	18.407 ± 0.003 Å
α	90°
β	93.33 ± 0.002°
γ	90°
Cell volume	1527.4 ± 0.4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/n 1
Hall space group symbol	-P 2yac
Residual factor for all reflections	0.0472
Residual factor for significantly intense reflections	0.0388
Weighted residual factors for significantly intense reflections	0.0949
Weighted residual factors for all reflections included in the refinement	0.0998
Goodness-of-fit parameter for all reflections included in the refinement	1.044
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
179108 (current)	2016-03-23	cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/70.	4307093.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4307093.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4307093.cif
1194	2010-06-06	cif/4/ Adding data from Inorg-Chem-2007_01-13/ processing directory.	4307093.cif