Crystallography Open Database

Information card for entry 2236324

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Structure parameters

Chemical name	Bis(chlorido)(dimethylsulfoxide-κO)barium(II)
Formula	C2 H6 Ba Cl2 O S
Calculated formula	C2 H6 Ba Cl2 O S
Title of publication	Bis(chlorido)(dimethylsulfoxide-κO)barium(II)
Authors of publication	Gschwind, Fabienne; Jansen, Martin
Journal of publication	Acta Crystallographica Section E
Year of publication	2012
Journal volume	68
Journal issue	11
Pages of publication	m1319
a	15.68 ± 0.007 Å
b	15.68 ± 0.007 Å
c	33.848 ± 0.006 Å
α	90°
β	90°
γ	120°
Cell volume	7207 ± 5 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	6
Space group number	167
Hermann-Mauguin space group symbol	R -3 c :H
Hall space group symbol	-R 3 2"c
Residual factor for all reflections	0.0235
Residual factor for significantly intense reflections	0.0229
Weighted residual factors for significantly intense reflections	0.0568
Weighted residual factors for all reflections included in the refinement	0.0572
Goodness-of-fit parameter for all reflections included in the refinement	1.248
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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