Crystallography Open Database

Information card for entry 8105851

Preview

Coordinates	8105851.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H26 Cl4 O S Sn
Calculated formula	C28 H26 Cl4 O S Sn
SMILES	[Sn](Cl)(Cl)([O]=S(Cc1ccccc1)Cc1ccccc1)(Cc1c(Cl)cccc1)Cc1c(Cl)cccc1
Title of publication	Crystal structure of (dibenzyl sulphoxide-κO)bis(2-chlorobenzyl-κC 1)dichloridotin(IV), C28H26Cl4OSSn
Authors of publication	Lee, See Mun; Lo, Kong Mun; Tiekink, Edward R.T.
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2019
Journal volume	234
Journal issue	4
Pages of publication	787 - 789
a	10.6342 ± 0.0002 Å
b	12.9298 ± 0.0003 Å
c	20.3576 ± 0.0004 Å
α	90°
β	101.82 ± 0.001°
γ	90°
Cell volume	2739.78 ± 0.1 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0209
Residual factor for significantly intense reflections	0.0197
Weighted residual factors for significantly intense reflections	0.0513
Weighted residual factors for all reflections included in the refinement	0.052
Goodness-of-fit parameter for all reflections included in the refinement	1.021
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
278116 (current)	2022-09-23	cif/ Adding structures of 8105851 via cif-deposit CGI script.	8105851.cif