Crystallography Open Database

Information card for entry 7709926

Preview

Coordinates	7709926.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C33 H19.5 Cl8 Dy N7.5 O9
Calculated formula	C33 H19.5 Cl8 Dy N7.5 O9
Title of publication	Reversible on-off switching of Dy(III) single-molecule magnets via single-crystal-to-single-crystal transformation
Authors of publication	Xi, Jing; Cen, Peipei; Guo, Yan; Li, Yuzhu; Qin, Yuanyuan; Zhang, Yi-Quan; Song, Weiming; Liu, Xiangyu
Journal of publication	Dalton Transactions
Year of publication	2022
a	11.2759 ± 0.0007 Å
b	13.1435 ± 0.0009 Å
c	15.0492 ± 0.0009 Å
α	85.319 ± 0.005°
β	68.224 ± 0.006°
γ	73.146 ± 0.006°
Cell volume	1981.4 ± 0.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0621
Residual factor for significantly intense reflections	0.0475
Weighted residual factors for significantly intense reflections	0.0842
Weighted residual factors for all reflections included in the refinement	0.0915
Goodness-of-fit parameter for all reflections included in the refinement	1.079
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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