Crystallography Open Database

Information card for entry 7717440

Preview

Coordinates	7717440.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C90 H94 Cl2 Dy6 F6 N24 O28
Calculated formula	C90 H94 Cl2 Dy6 F6 N24 O28
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	14.6944 ± 0.0001 Å
b	17.5692 ± 0.0002 Å
c	21.476 ± 0.0002 Å
α	79.751 ± 0.001°
β	86.882 ± 0.001°
γ	75.023 ± 0.001°
Cell volume	5270.42 ± 0.09 Å³
Cell temperature	170 ± 0.1 K
Ambient diffraction temperature	170 ± 0.1 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.022
Residual factor for significantly intense reflections	0.019
Weighted residual factors for significantly intense reflections	0.0474
Weighted residual factors for all reflections included in the refinement	0.049
Goodness-of-fit parameter for all reflections included in the refinement	1.031
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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