Crystallography Open Database

Information card for entry 7717437

Preview

Coordinates	7717437.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C69 H73 Dy5 F5 N20 O28.5
Calculated formula	C69 H71 Dy5 F5 N20 O28.4999
Title of publication	Solvent-dependent Ln(III) clusters assembled by immobilization of CO2 in the air: zero-field single-molecule magnets and magnetic refrigerant materials
Authors of publication	Liu, Cai-Ming; Hao, Xiang; Hu, Zhao-Bo; Wen, He-Rui
Journal of publication	Dalton Transactions
Year of publication	2024
a	14.4896 ± 0.0003 Å
b	17.1556 ± 0.0003 Å
c	19.511 ± 0.0005 Å
α	105.243 ± 0.002°
β	102.278 ± 0.002°
γ	100.515 ± 0.001°
Cell volume	4423.73 ± 0.18 Å³
Cell temperature	170 ± 0.1 K
Ambient diffraction temperature	170 ± 0.1 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	0.0459
Residual factor for significantly intense reflections	0.0382
Weighted residual factors for significantly intense reflections	0.1024
Weighted residual factors for all reflections included in the refinement	0.1104
Goodness-of-fit parameter for all reflections included in the refinement	1.026
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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