Crystallography Open Database

Information card for entry 7043490

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Coordinates	7043490.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Cl3 Cu3 H6 Nd O6
Calculated formula	Cl3 Cu3 H6 Nd O6
Title of publication	Strong spin frustration and negative magnetization in LnCu3(OH)6Cl3 (Ln = Nd and Sm) with triangular lattices: The effects of lanthanides
Authors of publication	Sun, Wei; Huang, Ya-Xi; Pan, Yuanming; Mi, Jin-Xiao
Journal of publication	Dalton Trans.
Year of publication	2017
a	6.8645 ± 0.0007 Å
b	6.8645 ± 0.0007 Å
c	5.6391 ± 0.0012 Å
α	90°
β	90°
γ	120°
Cell volume	230.12 ± 0.06 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
Space group number	164
Hermann-Mauguin space group symbol	P -3 m 1
Hall space group symbol	-P 3 2"
Residual factor for all reflections	0.0109
Residual factor for significantly intense reflections	0.0109
Weighted residual factors for significantly intense reflections	0.037
Weighted residual factors for all reflections included in the refinement	0.0371
Goodness-of-fit parameter for all reflections included in the refinement	1.038
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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