Crystallography Open Database

Information card for entry 2105642

Preview

Coordinates	2105642.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	Dimethylammonium Tetrachlorocobaltate(II)
Formula	C4 H16 Cl4 Co N2
Calculated formula	C4 H16 Cl4 Co N2
SMILES	[Co](Cl)(Cl)([Cl-])[Cl-].[NH2+](C)C.[NH2+](C)C
Title of publication	Structure of [(CH~3~)~2~NH~2~]~2~CoCl~4~ at elevated temperatures
Authors of publication	Mahmoudkhani, Amir H.; Langer, Vratislav
Journal of publication	Acta Crystallographica Section B
Year of publication	1999
Journal volume	55
Journal issue	5
Pages of publication	752 - 757
a	8.5775 ± 0.0005 Å
b	11.4679 ± 0.0006 Å
c	13.3855 ± 0.0006 Å
α	90°
β	90.021 ± 0.001°
γ	90°
Cell volume	1316.68 ± 0.12 Å³
Cell temperature	366 ± 2 K
Ambient diffraction temperature	366 ± 2 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 all reflections	0.0653
Residual factor for significantly intense reflections	0.0371
Weighted residual factors for all reflections included in the refinement	0.0922
Goodness-of-fit parameter for all reflections included in the refinement	1.006
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
176768 (current)	2016-02-20	cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/10.	2105642.cif
90939	2013-11-21	cif/ Adding structures of 2105639, 2105640, 2105641, 2105642 via cif-deposit CGI script.	2105642.cif