Crystallography Open Database

Information card for entry 7126075

Preview

Coordinates	7126075.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C84 H138 Cl16 Dy6 K4 O6
Calculated formula	C84 H138 Cl16 Dy6 K4 O6
Title of publication	Hexanuclear [Cp*Dy]<sub>6</sub> single-molecule magnet.
Authors of publication	Wu, Jianfeng; Demeshko, Serhiy; Dechert, Sebastian; Meyer, Franc
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2020
Journal volume	56
Journal issue	27
Pages of publication	3887 - 3890
a	13.9788 ± 0.0002 Å
b	16.4794 ± 0.0002 Å
c	37.2813 ± 0.0006 Å
α	85.933 ± 0.001°
β	84.334 ± 0.001°
γ	70.868 ± 0.001°
Cell volume	8067.4 ± 0.2 Å³
Cell temperature	133 ± 2 K
Ambient diffraction temperature	133 ± 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	0.0439
Residual factor for significantly intense reflections	0.0372
Weighted residual factors for significantly intense reflections	0.0982
Weighted residual factors for all reflections included in the refinement	0.1059
Goodness-of-fit parameter for all reflections included in the refinement	1.049
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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