Crystallography Open Database

Information card for entry 7230274

Preview

Coordinates	7230274.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C82 H416 Cl25 Gd45 Ni7 O388
Calculated formula	C70 H148 Cl4 Gd45 Ni7 O251
Title of publication	Four 3d‒4f heterometallic Ln45M7 clusters protected by mixed ligands
Authors of publication	Fan, Shen; Xu, Su-Hui; Zheng, Xiu-Ying; Yan, Zhi-Hao; Kong, Xiang-Jian; Long, La-Sheng; Zheng, Lan-Sun
Journal of publication	CrystEngComm
Year of publication	2018
Journal volume	20
Journal issue	15
Pages of publication	2120
a	31.6894 ± 0.001 Å
b	36.5011 ± 0.0011 Å
c	39.6432 ± 0.0015 Å
α	90°
β	107.229 ± 0.003°
γ	90°
Cell volume	43798 ± 3 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
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	0.2456
Residual factor for significantly intense reflections	0.124
Weighted residual factors for significantly intense reflections	0.2658
Weighted residual factors for all reflections included in the refinement	0.3184
Goodness-of-fit parameter for all reflections included in the refinement	1.053
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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