Crystallography Open Database

Information card for entry 7045776

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Coordinates	7045776.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C51 H24 Co2 F24 N6 O8
Calculated formula	C51 H24 Co2 F24 N6 O8
Title of publication	Impact of nuclearity and topology on the single molecule magnet behaviour of hexaazatrinaphtylene-based cobalt complexes.
Authors of publication	Lemes, Maykon A.; Magnan, François; Gabidullin, Bulat; Brusso, Jaclyn
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2018
Journal volume	47
Journal issue	13
Pages of publication	4678 - 4684
a	18.2906 ± 0.0007 Å
b	9.6629 ± 0.0004 Å
c	31.6337 ± 0.0013 Å
α	90°
β	97.589 ± 0.001°
γ	90°
Cell volume	5542 ± 0.4 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0657
Residual factor for significantly intense reflections	0.0428
Weighted residual factors for significantly intense reflections	0.1013
Weighted residual factors for all reflections included in the refinement	0.1135
Goodness-of-fit parameter for all reflections included in the refinement	1.017
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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