Crystallography Open Database

Information card for entry 7237088

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Coordinates	7237088.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C5 H6 Cu O6
Calculated formula	C5 H6 Cu O6
Title of publication	Magnetostructural relationships in polymorphic ethylmalonate-containing copper(ii) coordination polymers
Authors of publication	Pasán, Jorge; Sanchiz, Joaquín; Lloret, Francesc; Julve, Miguel; Ruiz-Pérez, Catalina
Journal of publication	CrystEngComm
Year of publication	2018
Journal volume	20
Journal issue	46
Pages of publication	7464
a	11.5965 ± 0.0008 Å
b	11.5965 ± 0.0008 Å
c	10.5437 ± 0.0006 Å
α	90°
β	90°
γ	120°
Cell volume	1227.94 ± 0.14 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	170
Hermann-Mauguin space group symbol	P 65
Hall space group symbol	P 65
Residual factor for all reflections	0.0558
Residual factor for significantly intense reflections	0.0509
Weighted residual factors for significantly intense reflections	0.1333
Weighted residual factors for all reflections included in the refinement	0.1356
Goodness-of-fit parameter for all reflections included in the refinement	1.159
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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