Crystallography Open Database

Information card for entry 4347388

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Coordinates	4347388.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C80 H60 B4 Co4 F16 N32
Calculated formula	C80 H60 B4 Co4 F16 N32
Title of publication	Redox-Induced Single-Molecule Magnetism in Mixed-Valent [2 ×2] Co4 Grid Complexes.
Authors of publication	Tong, Jin; Demeshko, Serhiy; John, Michael; Dechert, Sebastian; Meyer, Franc
Journal of publication	Inorganic chemistry
Year of publication	2016
Journal volume	55
Journal issue	9
Pages of publication	4362 - 4372
a	17.2359 ± 0.0003 Å
b	17.2359 ± 0.0003 Å
c	13.2617 ± 0.0002 Å
α	90°
β	90°
γ	90°
Cell volume	3939.74 ± 0.11 Å³
Cell temperature	133 ± 2 K
Ambient diffraction temperature	133 ± 2 K
Number of distinct elements	6
Space group number	86
Hermann-Mauguin space group symbol	P 42/n :2
Hall space group symbol	-P 4bc
Residual factor for all reflections	0.0359
Residual factor for significantly intense reflections	0.0314
Weighted residual factors for significantly intense reflections	0.0751
Weighted residual factors for all reflections included in the refinement	0.0775
Goodness-of-fit parameter for all reflections included in the refinement	1.08
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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