Crystallography Open Database

Information card for entry 7048734

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Coordinates	7048734.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H49 Gd3 N8 O21
Calculated formula	C22 H49 Gd3 N8 O21
Title of publication	Solvent-induced formation of two gadolinium clusters demonstrating strong magnetocaloric effects and ferroelectric properties.
Authors of publication	Wang, Yu-Xia; Xu, Qiutong; Ren, Peng; Shi, Wei; Cheng, Peng
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	6
Pages of publication	2228 - 2233
a	28.4536 ± 0.0006 Å
b	14.97 ± 0.0003 Å
c	9.1074 ± 0.0002 Å
α	90°
β	90°
γ	90°
Cell volume	3879.3 ± 0.14 Å³
Cell temperature	353 ± 0.14 K
Ambient diffraction temperature	353 ± 0.14 K
Number of distinct elements	5
Space group number	33
Hermann-Mauguin space group symbol	P n a 21
Hall space group symbol	P 2c -2n
Residual factor for all reflections	0.044
Residual factor for significantly intense reflections	0.0356
Weighted residual factors for significantly intense reflections	0.0516
Weighted residual factors for all reflections included in the refinement	0.0541
Goodness-of-fit parameter for all reflections included in the refinement	0.975
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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