Crystallography Open Database

Information card for entry 7213936

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Coordinates	7213936.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C21 H11 F18 Ho N4 O6
Calculated formula	C21 H11 F18 Ho N4 O6
Title of publication	A new D2d-symmetry DyIII mononuclear single-molecule magnet containing a monodentate N-heterocyclic donor ligand
Authors of publication	Wang, Ya-Li; Gu, Bin; Ma, Yue; Xing, Cui; Wang, Qing-Lun; Li, Li-Cun; Cheng, Peng; Liao, Dai-Zheng
Journal of publication	CrystEngComm
Year of publication	2014
Journal volume	16
Journal issue	11
Pages of publication	2283
a	8.935 ± 0.0018 Å
b	22.252 ± 0.004 Å
c	16.011 ± 0.003 Å
α	90°
β	97.77 ± 0.03°
γ	90°
Cell volume	3154.1 ± 1.1 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.0826
Residual factor for significantly intense reflections	0.0602
Weighted residual factors for significantly intense reflections	0.1381
Weighted residual factors for all reflections included in the refinement	0.1498
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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