Crystallography Open Database

Information card for entry 4342492

Preview

Coordinates	4342492.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C3 H6 Cu I S3
Calculated formula	C3 H6 Cu I S3
Title of publication	Impact of Ligand Framework on the Crystal Structures and Luminescent Properties of Cu(I) and Ag(I) Clusters and a Coordination Polymer Derived from Thiolate/Iodide/dppm Ligands.
Authors of publication	Rajput, Gunjan; Yadav, Manoj Kumar; Drew, Michael G. B.; Singh, Nanhai
Journal of publication	Inorganic chemistry
Year of publication	2015
Journal volume	54
Journal issue	6
Pages of publication	2572 - 2579
a	4.198 ± 0.0009 Å
b	9.9115 ± 0.0014 Å
c	10.8971 ± 0.0013 Å
α	79.511 ± 0.011°
β	79.461 ± 0.009°
γ	79.925 ± 0.01°
Cell volume	433.58 ± 0.12 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.052
Residual factor for significantly intense reflections	0.044
Weighted residual factors for significantly intense reflections	0.1036
Weighted residual factors for all reflections included in the refinement	0.1136
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
179527 (current)	2016-03-24	cif/4/34/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/34/24.	4342492.cif
134782	2015-04-04	cif/ Updating files of 4342490, 4342491, 4342492 Original log message: Adding full bibliography for 4342490--4342492.cif.	4342492.cif
132245	2015-02-22	cif/ Adding structures of 4342492 via cif-deposit CGI script.	4342492.cif