Crystallography Open Database

Information card for entry 7057869

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Coordinates	7057869.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C44 H60 Co4 N16 O8
Calculated formula	C44 H60 Co4 N16 O8
Title of publication	Rare azido and hydroxido bridged tetranuclear Co(II) complexes of a polynucleating Mannich base ligand with defect dicubane core: Structures, magnetism and phenoxazinone synthase like activity
Authors of publication	Das, Avijit; Goswami, Soumyabrata; Ghosh, Ashutosh
Journal of publication	New Journal of Chemistry
Year of publication	2018
a	32.2276 ± 0.0007 Å
b	32.2276 ± 0.0007 Å
c	13.8386 ± 0.0003 Å
α	90°
β	90°
γ	120°
Cell volume	12447.4 ± 0.5 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298.15 K
Number of distinct elements	5
Space group number	148
Hermann-Mauguin space group symbol	R -3
Hall space group symbol	-R 3
Residual factor for all reflections	0.0518
Residual factor for significantly intense reflections	0.0435
Weighted residual factors for significantly intense reflections	0.1287
Weighted residual factors for all reflections included in the refinement	0.1406
Goodness-of-fit parameter for all reflections included in the refinement	1.074
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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