Crystallography Open Database

Information card for entry 7719046

7719045 << 7719046 >> 7719047

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Coordinates	7719046.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C50 H72 Dy2 N4 O12
Calculated formula	C50 H72 Dy2 N4 O12
Title of publication	Impacts of β-diketonate terminal ligands on slow magnetic relaxation and luminescence thermometry in dinuclear Dy<sup>III</sup> single-molecule magnets.
Authors of publication	Germano Bispo-Jr, Airton; Alves Gálico, Diogo; Ovens, Jeffrey S.; Aparecido Sigoli, Fernando; Murugesu, Muralee
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2025
Journal volume	54
Journal issue	12
Pages of publication	4876 - 4887
a	9.3079 ± 0.0006 Å
b	11.811 ± 0.0008 Å
c	13.0703 ± 0.0009 Å
α	69.97 ± 0.001°
β	84.764 ± 0.002°
γ	80.764 ± 0.002°
Cell volume	1331.46 ± 0.16 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0881
Residual factor for significantly intense reflections	0.0478
Weighted residual factors for significantly intense reflections	0.0631
Weighted residual factors for all reflections included in the refinement	0.0733
Goodness-of-fit parameter for all reflections included in the refinement	1.018
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
300369 (current)	2025-07-05	cif/ Adding structures of 7719045, 7719046 via cif-deposit CGI script.	7719046.cif