Crystallography Open Database

Information card for entry 7704179

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Coordinates	7704179.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C173 H208 Cl6 Co4 N22 O28
Calculated formula	C173 H208 Cl6 Co4 N22 O28
Title of publication	Effects of ligand substituents on the single-molecule magnetic behavior of quinonoid-bridged dicobalt compounds.
Authors of publication	Zhu, Xiao-Quan; Cao, Wen-Hai; Su, Shao-Dong; Wu, Xin-Tao; Sheng, Tian-Lu
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	20
Pages of publication	6738 - 6743
a	18.947 ± 0.005 Å
b	16.237 ± 0.004 Å
c	31.011 ± 0.006 Å
α	90°
β	114.933 ± 0.012°
γ	90°
Cell volume	8651 ± 4 Å³
Cell temperature	123 ± 2 K
Ambient diffraction temperature	123 ± 2 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	0.0775
Residual factor for significantly intense reflections	0.0679
Weighted residual factors for significantly intense reflections	0.183
Weighted residual factors for all reflections included in the refinement	0.195
Goodness-of-fit parameter for all reflections included in the refinement	1.011
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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