Crystallography Open Database

Information card for entry 7125601

Preview

Coordinates	7125601.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C72 H92 Cu4 Dy4 N12 O46
Calculated formula	C72 H92 Cu4 Dy4 N12 O46
Title of publication	An octanuclear {Cu(II)4Dy(III)4} coordination cluster showing single molecule magnet behaviour from field accessible states.
Authors of publication	Kühne, Irina A; Magnani, Nicola; Mereacre, Valeriu; Wernsdorfer, Wolfgang; Anson, Christopher E.; Powell, Annie K.
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2014
Journal volume	50
Journal issue	15
Pages of publication	1882 - 1885
a	24.7894 ± 0.001 Å
b	14.3443 ± 0.0008 Å
c	25.929 ± 0.0011 Å
α	90°
β	90°
γ	90°
Cell volume	9220 ± 0.7 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0687
Residual factor for significantly intense reflections	0.0566
Weighted residual factors for significantly intense reflections	0.1363
Weighted residual factors for all reflections included in the refinement	0.1428
Goodness-of-fit parameter for all reflections included in the refinement	1
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
244388 (current)	2019-11-28	cif/ Adding structures of 7125601, 7125602 via cif-deposit CGI script.	7125601.cif