Crystallography Open Database

Information card for entry 1512441

Preview

Coordinates	1512441.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H38 Ag2 N4 O12 S2
Calculated formula	C28 H38 Ag2 N4 O12 S2
SMILES	[Ag]1(OS(=O)(=O)C)[N]2=C(OCC2)c2cccc(c2)C2OCC[N]=2[Ag](OS(=O)(=O)C)[N]2=C(OCC2)c2cc(ccc2)C2OCC[N]1=2.OC.OC
Title of publication	Silver(I) complexes with oxazoline-containing bidentate ligands: Syntheses, structures and properties
Authors of publication	Yue Zhao; Ling-Ling Zhai; Gao-Chao Lv; Xin Zhou; Wei-Yin Sun
Journal of publication	Inorganica Chimica Acta
Year of publication	2012
Journal volume	392
Pages of publication	38 - 45
a	15.5 ± 0.002 Å
b	8.5536 ± 0.0012 Å
c	25.822 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	3423.5 ± 0.8 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.1057
Residual factor for significantly intense reflections	0.0996
Weighted residual factors for significantly intense reflections	0.3088
Weighted residual factors for all reflections included in the refinement	0.3135
Goodness-of-fit parameter for all reflections included in the refinement	1.079
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
176729 (current)	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1.	1512441.cif
120071	2014-07-11	Adding DOIs to range 1 structures.	1512441.cif
89370	2013-10-24	cif/ Adding structures of 1512441 via cif-deposit CGI script.	1512441.cif