Crystallography Open Database

Information card for entry 8105457

Preview

Coordinates	8105457.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C26 H22 Cl4 N2 O S Sn
Calculated formula	C26 H22 Cl4 N2 O S Sn
SMILES	[Sn]1(Cl)(Cl)([n]2cccc3ccc4ccc[n]1c4c23)(c1ccc(Cl)cc1)c1ccc(Cl)cc1.S(=O)(C)C
Title of publication	Crystal structure of trans-dichloridobis(4-chlorophenyl-κC 1)(1,10-phenanthroline-κ2 N,N′)tin(IV) dimethylsulphoxide solvate, C26H22Cl4N2OSSn
Authors of publication	Lo, Kong Mun; Lee, See Mun; Tiekink, Edward R.T.
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2020
Journal volume	235
Journal issue	6
Pages of publication	1327 - 1329
a	8.2966 ± 0.0001 Å
b	11.4971 ± 0.0002 Å
c	14.3311 ± 0.0002 Å
α	90.322 ± 0.002°
β	101.783 ± 0.001°
γ	95.78 ± 0.001°
Cell volume	1330.91 ± 0.03 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0269
Residual factor for significantly intense reflections	0.0258
Weighted residual factors for significantly intense reflections	0.0675
Weighted residual factors for all reflections included in the refinement	0.0684
Goodness-of-fit parameter for all reflections included in the refinement	1.033
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
276163 (current)	2022-06-23	cif/ Adding structures of 8105457 via cif-deposit CGI script.	8105457.cif