Crystallography Open Database

Information card for entry 7056490

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Coordinates	7056490.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C39 H44 Cl2 F9 N6 O10 Tb
Calculated formula	C38 H42 F9 N6 O10 Tb
Title of publication	Functionalized nitronyl nitroxide biradical bridged one-dimensional lanthanide chains: slow magnetic relaxation in the Tb and Dy analogues
Authors of publication	Li, Hongdao; Sun, Juan; Yang, Meng; Sun, Zan; Xie, Jing; Ma, Yue; Li, Licun
Journal of publication	New J. Chem.
Year of publication	2017
Journal volume	41
Journal issue	18
Pages of publication	10181 - 10188
a	11.3578 ± 0.0003 Å
b	21.8234 ± 0.0004 Å
c	19.0928 ± 0.0003 Å
α	90°
β	92.349 ± 0.002°
γ	90°
Cell volume	4728.48 ± 0.17 Å³
Cell temperature	113 ± 2 K
Ambient diffraction temperature	113 ± 2 K
Number of distinct elements	7
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	0.0881
Residual factor for significantly intense reflections	0.0679
Weighted residual factors for significantly intense reflections	0.1786
Weighted residual factors for all reflections included in the refinement	0.1946
Goodness-of-fit parameter for all reflections included in the refinement	1.001
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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