Crystallography Open Database

Information card for entry 4306577

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Coordinates	4306577.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	Erbium Copper Crotonate, hydrate
Formula	C40 H64 Cu2 Er2 O27
Calculated formula	C40 H50 Cu2 Er2 O27
Title of publication	1-D Polymers with Alternate Cu2 and Ln2 Units (Ln = Gd, Er, Y) and Carboxylate Linkages
Authors of publication	Rafael Calvo; Raul E. Rapp; Edson Chagas; Rosana P. Sartoris; Ricardo Baggio; María T. Garland; Mireille Perec
Journal of publication	Inorganic Chemistry
Year of publication	2008
Journal volume	47
Pages of publication	10389 - 10397
a	13.8721 ± 0.001 Å
b	22.0682 ± 0.0015 Å
c	19.8387 ± 0.0014 Å
α	90°
β	107.137 ± 0.001°
γ	90°
Cell volume	5803.6 ± 0.7 Å³
Cell temperature	294 ± 2 K
Ambient diffraction temperature	294 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0937
Residual factor for significantly intense reflections	0.0511
Weighted residual factors for significantly intense reflections	0.1217
Weighted residual factors for all reflections included in the refinement	0.1364
Goodness-of-fit parameter for all reflections included in the refinement	0.956
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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