Crystallography Open Database

Information card for entry 1564750

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Coordinates	1564750.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C94 H70 Cl4 Dy2 N4 O11
Calculated formula	C94 H64 Cl4 Dy2 N4 O11
Title of publication	Modulating SMM behaviors in phenoxo-O bridged Dy2 compounds via different β-diketonate
Authors of publication	Ling Hou, Yin; Yang, Ting-Ting; Zhao, Wen-Xin; Fan, Chen-Juan; Yan, Li-Li; Guan, Xiao-Fen; Ji, Jia; Wang, Wen-Min
Journal of publication	Inorganica Chimica Acta
Year of publication	2020
Journal volume	507
Pages of publication	119595
a	11.126 ± 0.002 Å
b	23.786 ± 0.005 Å
c	15.314 ± 0.003 Å
α	90°
β	101.15 ± 0.03°
γ	90°
Cell volume	3976.2 ± 1.4 Å³
Cell temperature	113 ± 2 K
Ambient diffraction temperature	113 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.043
Residual factor for significantly intense reflections	0.0341
Weighted residual factors for significantly intense reflections	0.0834
Weighted residual factors for all reflections included in the refinement	0.0921
Goodness-of-fit parameter for all reflections included in the refinement	1.103
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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