Crystallography Open Database

Information card for entry 8103351

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Coordinates	8103351.cif

Structure parameters

Formula	C22 H28 Cl4 Mn N4 O3
Calculated formula	C22 H28 Cl4 Mn N4 O3
Title of publication	Crystal structure of bis(3,5-dichloro-N-2-(dimethylamino)ethylsalicylaldiminato-k3N,N',O)manganese(II) monohydrate, Mn(C11H13Cl2N2O)2 · H2O
Authors of publication	Limei Wang; Xifeng Zhang; Wanyong Zeng; Zhiguo Liu; Lieju Liu
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2012
Journal volume	227
Journal issue	2
Pages of publication	261
a	12.3759 ± 0.0015 Å
b	9.249 ± 0.0012 Å
c	22.827 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	2612.9 ± 0.6 Å³
Cell temperature	291 ± 2 K
Ambient diffraction temperature	291 ± 2 K
Number of distinct elements	6
Space group number	60
Hermann-Mauguin space group symbol	P b c n
Hall space group symbol	-P 2n 2ab
Residual factor for all reflections	0.0472
Residual factor for significantly intense reflections	0.0357
Weighted residual factors for significantly intense reflections	0.1042
Weighted residual factors for all reflections included in the refinement	0.1116
Goodness-of-fit parameter for all reflections included in the refinement	1.008
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
211175 (current)	2018-09-26	cif/ Removing _chemical_name_systematic and _chemical_name_common data items with placeholder values from 513 entries in range 8.	8103351.cif
176728	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.	8103351.cif
62112	2012-07-07	cif/ Adding structures of 8103351 via cif-deposit CGI script.	8103351.cif