Crystallography Open Database

Information card for entry 7708021

Preview

Coordinates	7708021.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H72 Cl2 Dy2 N2 O18 Ru2
Calculated formula	C48 H72 Cl2 Dy2 N2 O18 Ru2
Title of publication	Enhancing the barrier height for magnetization reversal in 4d/4f RuIII2LnIII2 "butterfly" single molecule magnets (Ln = Gd, Dy) <i>via</i> targeted structural alterations.
Authors of publication	Swain, Abinash; Martin, Robert; Vignesh, Kuduva R.; Rajaraman, Gopalan; Murray, Keith S.; Langley, Stuart K.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2021
Journal volume	50
Journal issue	35
Pages of publication	12265 - 12274
a	20.986 ± 0.003 Å
b	20.986 ± 0.003 Å
c	27.302 ± 0.006 Å
α	90°
β	90°
γ	120°
Cell volume	10413 ± 3 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	7
Space group number	184
Hermann-Mauguin space group symbol	P 6 c c
Hall space group symbol	P 6 -2c
Residual factor for all reflections	0.0561
Residual factor for significantly intense reflections	0.0502
Weighted residual factors for significantly intense reflections	0.1634
Weighted residual factors for all reflections included in the refinement	0.1719
Goodness-of-fit parameter for all reflections included in the refinement	1.049
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	synchrotron
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
269729 (current)	2021-10-06	cif/ Updating files of 7708021, 7708022, 7708023, 7708024, 7708025 Original log message: Adding full bibliography for 7708021--7708025.cif.	7708021.cif
268039	2021-08-12	cif/ Adding structures of 7708021, 7708022, 7708023, 7708024, 7708025 via cif-deposit CGI script.	7708021.cif