Crystallography Open Database

Information card for entry 7717056

Preview

Coordinates	7717056.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C76 H92 Cu6 N20 O44 Y4
Calculated formula	C76 H92 Cu6 N20 O44 Y4
Title of publication	A new family of heterometallic [Cu6M4] (M = Gd, Tb, Dy and Y) clusters derived from the combined use of selected pyridyl poly-alcohol ligands
Authors of publication	Anastassiades, Antonis; Alexandropoulos, Dimitris I.; Buch, Christian D.; Piligkos, Stergios; Tasiopoulos, Anastasios J.
Journal of publication	Dalton Transactions
Year of publication	2024
a	17.7509 ± 0.0001 Å
b	17.7509 ± 0.0001 Å
c	16.2759 ± 0.0002 Å
α	90°
β	90°
γ	90°
Cell volume	5128.45 ± 0.08 Å³
Cell temperature	150.1 ± 0.2 K
Ambient diffraction temperature	150.1 ± 0.2 K
Number of distinct elements	6
Space group number	114
Hermann-Mauguin space group symbol	P -4 21 c
Hall space group symbol	P -4 2n
Residual factor for all reflections	0.0217
Residual factor for significantly intense reflections	0.0215
Weighted residual factors for significantly intense reflections	0.0594
Weighted residual factors for all reflections included in the refinement	0.0595
Goodness-of-fit parameter for all reflections included in the refinement	1.067
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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