Crystallography Open Database

Information card for entry 4325725

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Coordinates	4325725.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C114 H110 Cr2 Mn6 N24 O19
Calculated formula	C114 H110 Cr2 Mn6 N24 O19
Title of publication	Synthesis, Structure, and Magnetic Properties of Three 1D Chain Complexes Based on High-Spin Metal-Cyanide Clusters: [MnIII6MIII] (M = Cr, Fe, Co)
Authors of publication	Hong-Bo Zhou; Jun Wang; Hui-Sheng Wang; Yong-Lu Xu; Xiao-Jiao Song; You Song; Xiao-Zeng You
Journal of publication	Inorganic Chemistry
Year of publication	2011
Journal volume	50
Pages of publication	6868 - 6877
a	14.188 ± 0.007 Å
b	15.174 ± 0.008 Å
c	16.069 ± 0.007 Å
α	76.896 ± 0.01°
β	79.473 ± 0.01°
γ	66.342 ± 0.009°
Cell volume	3070 ± 3 Å³
Cell temperature	291 ± 2 K
Ambient diffraction temperature	291 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0938
Residual factor for significantly intense reflections	0.0563
Weighted residual factors for significantly intense reflections	0.1061
Weighted residual factors for all reflections included in the refinement	0.1146
Goodness-of-fit parameter for all reflections included in the refinement	1.026
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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