Crystallography Open Database

Information card for entry 7003068

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Coordinates	7003068.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C56 H120 Cu4 Gd4 N8 O42
Calculated formula	C56 H88 Cu4 Gd4 N8 O42
Title of publication	A new family of octanuclear Cu4Ln4 (Ln = Gd, Tb and Dy) spin clusters
Authors of publication	Alley, Kerwyn G.; Mukherjee, Arindam; Clérac, Rodolphe; Boskovic, Colette
Journal of publication	Dalton Transactions
Year of publication	2008
Journal issue	1
Pages of publication	59
a	10.9922 ± 0.0005 Å
b	14.6055 ± 0.0007 Å
c	15.0253 ± 0.0007 Å
α	72.942 ± 0.001°
β	87.723 ± 0.001°
γ	69.753 ± 0.001°
Cell volume	2158.5 ± 0.18 Å³
Cell temperature	130 ± 2 K
Ambient diffraction temperature	130 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0522
Residual factor for significantly intense reflections	0.0498
Weighted residual factors for significantly intense reflections	0.0988
Weighted residual factors for all reflections included in the refinement	0.1
Goodness-of-fit parameter for all reflections included in the refinement	1.24
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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