Crystallography Open Database

Information card for entry 4508748

Preview

Coordinates	4508748.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C4 H11 Ag O3 S3
Calculated formula	C4 H11 Ag O3 S3
Title of publication	Influence of the Anion on the Structure of Bis(methylthio)methane Supramolecular Coordination Complexes
Authors of publication	Awaleh, Mohamed Osman; Badia, Antonella; Brisse, François
Journal of publication	Crystal Growth & Design
Year of publication	2006
Journal volume	6
Journal issue	12
Pages of publication	2674
a	9.6279 ± 0.0005 Å
b	7.4958 ± 0.0004 Å
c	13.572 ± 0.0007 Å
α	90°
β	91.702 ± 0.002°
γ	90°
Cell volume	979.04 ± 0.09 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.027
Residual factor for significantly intense reflections	0.0262
Weighted residual factors for significantly intense reflections	0.0732
Weighted residual factors for all reflections included in the refinement	0.0737
Goodness-of-fit parameter for all reflections included in the refinement	1.08
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179623 (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 4/50/87.	4508748.cif
96905	2014-01-29	cif/ Adding structures of 4508748 via cif-deposit CGI script.	4508748.cif