Crystallography Open Database

Information card for entry 2239401

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Structure parameters

Chemical name	Bis(acetato-κ<i>O</i>)bis(thiourea-κ<i>S</i>)cobalt(II)
Formula	C6 H14 Co N4 O4 S2
Calculated formula	C6 H14 Co N4 O4 S2
Title of publication	Bis(acetato-κ<i>O</i>)bis(thiourea-κ<i>S</i>)cobalt(II)
Authors of publication	Lutz, Martin
Journal of publication	Acta Crystallographica Section E
Year of publication	2014
Journal volume	70
Journal issue	3
Pages of publication	m78
a	7.15257 ± 0.00016 Å
b	17.2864 ± 0.0004 Å
c	11.7372 ± 0.0003 Å
α	90°
β	112.275 ± 0.001°
γ	90°
Cell volume	1342.92 ± 0.06 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 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	0.0174
Residual factor for significantly intense reflections	0.0157
Weighted residual factors for significantly intense reflections	0.0407
Weighted residual factors for all reflections included in the refinement	0.0414
Goodness-of-fit parameter for all reflections included in the refinement	1.043
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

Version history

Revision	Date	Message	Files
181894 (current)	2016-04-06	hkl/2/23/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/23/94.	2239401.cif 2239401.hkl
181313	2016-04-03	hkl/2/23/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23/94.	2239401.cif 2239401.hkl
176798	2016-02-21	cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23.	2239401.cif 2239401.hkl
110684	2014-04-19	cif/ hkl/ Adding structures of 2239401 via cif-deposit CGI script.	2239401.cif 2239401.hkl