Crystallography Open Database

Information card for entry 7721028

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Coordinates	Coordinates are not available: file is not found.
Original paper (by DOI)	HTML

Structure parameters

Formula	C34 H55 B9 Cl Dy K N3 O1.5
Calculated formula	C34 H55 B9 Cl Dy K N3 O1.5
Title of publication	Tripodal Tris(aryl)alkoxide Ligand in Tuning Single-Molecule Magnetism of Dy³⁺ Complexes
Authors of publication	Trifonov, Alexander A.; Félix, Gautier; Balagurova, Elena V.; Larionova, Joulia; Selikhov, Alexander N.; Kallio, Max; Vieru, Veacheslav; Vologzhanina, Anna V.; Guari, Yannick
Journal of publication	Dalton Transactions
Year of publication	2026
a	16.6956 ± 0.0006 Å
b	16.1043 ± 0.0005 Å
c	18.3134 ± 0.0006 Å
α	90°
β	111.7 ± 0.001°
γ	90°
Cell volume	4575 ± 0.3 Å³
Cell temperature	140 K
Ambient diffraction temperature	140 K
Number of distinct elements	8
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0552
Residual factor for significantly intense reflections	0.0359
Weighted residual factors for significantly intense reflections	0.086
Weighted residual factors for all reflections included in the refinement	0.091
Goodness-of-fit parameter for all reflections included in the refinement	1.002
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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