Crystallography Open Database

Information card for entry 8103102

Preview

Coordinates	8103102.cif

Structure parameters

Chemical name	bis[(μ~2~-chloro)(2,3,5,6-tetra-2-pyridylpyrazine)]dichlorodimanganese(II), Mn~2~Cl~4~(C~24~H~16~N~6~)~2~
Formula	C48 H32 Cl4 Mn2 N12
Calculated formula	C48 H32 Cl4 Mn2 N12
Title of publication	Crystal structure of di(μ2-chloro)-dichlorobis(2,3,5,6-tetra-2-pyridylpyrazine)dimanganese(II), Mn2Cl4(C24H16N6)2
Authors of publication	Kwang Ha
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2011
Journal volume	226
Journal issue	1
Pages of publication	59
a	9.2657 ± 0.0018 Å
b	10.675 ± 0.002 Å
c	12.214 ± 0.002 Å
α	101.691 ± 0.004°
β	107.474 ± 0.004°
γ	101.157 ± 0.004°
Cell volume	1085.8 ± 0.3 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0947
Residual factor for significantly intense reflections	0.0545
Weighted residual factors for significantly intense reflections	0.1016
Weighted residual factors for all reflections included in the refinement	0.1411
Goodness-of-fit parameter for all reflections included in the refinement	1.079
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.	8103102.cif
35911	2012-02-28	cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree.	8103102.cif
29033	2011-11-02	../uploads/cif-deposit/cod/cif Adding structures of 8103102 via cif-deposit CGI script.	8103102.cif