Crystallography Open Database

Information card for entry 4311922

4311921 << 4311922 >> 4311923

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Structure parameters

Formula	C12 H16 Co0.5 N5 O5
Calculated formula	C12 H16 Co0.5 N5 O5
Title of publication	Formation of One-Dimensional Metal-Water Chain Containing Cyclic Water Hexamers
Authors of publication	Bao-Hui Ye; Bing-Bing Ding; Yan-Qin Weng; Xiao-Ming Chen
Journal of publication	Inorganic Chemistry
Year of publication	2004
Journal volume	43
Pages of publication	6866 - 6868
a	8.7494 ± 0.0008 Å
b	9.4132 ± 0.0008 Å
c	10.2955 ± 0.0009 Å
α	105.3 ± 0.001°
β	101.326 ± 0.002°
γ	107.627 ± 0.001°
Cell volume	743.44 ± 0.11 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.0321
Residual factor for significantly intense reflections	0.0306
Weighted residual factors for significantly intense reflections	0.0855
Weighted residual factors for all reflections included in the refinement	0.0871
Goodness-of-fit parameter for all reflections included in the refinement	1.001
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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