Crystallography Open Database

Information card for entry 2202544

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Structure parameters

Formula	C6 H9 Co O3 S6
Calculated formula	C6 H9 Co O3 S6
SMILES	[Co]123(SC(=[S]1)OC)(SC(=[S]2)OC)SC(=[S]3)OC
Title of publication	Tris(<i>O</i>-methyl dithiocarbonato)cobalt(III)
Authors of publication	Tetsuzo Ito
Journal of publication	Acta Crystallographica Section E
Year of publication	2003
Journal volume	59
Journal issue	10
Pages of publication	m892 - m893
a	9.552 ± 0.001 Å
b	13.461 ± 0.001 Å
c	11.357 ± 0.001 Å
α	90°
β	106.235 ± 0.007°
γ	90°
Cell volume	1402 ± 0.2 Å³
Cell temperature	296.1 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 significantly intense reflections	0.029
Weighted residual factors for all reflections included in the refinement	0.036
Goodness-of-fit parameter for all reflections included in the refinement	1.66
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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