Crystallography Open Database

Information card for entry 8102868

Preview

Coordinates	8102868.cif

Structure parameters

Chemical name	bis(bis{2-[(2-isopropylaminoethylimino)methyl]- 5-methoxyphenolato}cobalt(III))tetrachlorocobalt(II), 2[Co(C~13~H~19~N~2~O~2~)~2~].[CoCl~4~]
Formula	C52 H76 Cl4 Co3 N8 O8
Calculated formula	C52 H76 Cl4 Co3 N8 O8
Title of publication	Crystal structure of bis(bis{2-[(2-isopropylaminoethylimino)methyl]-5-methoxyphenolato}cobalt(III)) tetrachlorocobaltate(II), [Co(C13H19N2O2)2]2[CoCl4]
Authors of publication	Ning Wang; Xiao-Yan Li
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2010
Journal volume	225
Journal issue	4
Pages of publication	803
a	26.206 ± 0.003 Å
b	16.655 ± 0.002 Å
c	17.081 ± 0.003 Å
α	90°
β	128.616 ± 0.002°
γ	90°
Cell volume	5825.1 ± 1.4 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0995
Residual factor for significantly intense reflections	0.0498
Weighted residual factors for significantly intense reflections	0.1161
Weighted residual factors for all reflections included in the refinement	0.1432
Goodness-of-fit parameter for all reflections included in the refinement	1.035
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
176728 (current)	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 8.	8102868.cif
35911	2012-02-28	cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree.	8102868.cif
13607	2011-03-06	../uploads/cif-deposit/cod/cif Adding structures of 8102868 via cif-deposit CGI script.	8102868.cif