Crystallography Open Database

Information card for entry 7054020

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Coordinates	7054020.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C5 H4 Cu N2 O4
Calculated formula	C5 H4 Cu N2 O4
Title of publication	Effect of N-donor ancillary ligands on structural and magnetic properties of oxalate copper(ii) complexes
Authors of publication	Świtlicka-Olszewska, Anna; Machura, Barbara; Mroziński, Jerzy; Kalińska, Bożena; Kruszynski, Rafał; Penkala, Mateusz
Journal of publication	New Journal of Chemistry
Year of publication	2014
Journal volume	38
Journal issue	4
Pages of publication	1611
a	8.5694 ± 0.0006 Å
b	9.3227 ± 0.0004 Å
c	8.4631 ± 0.0009 Å
α	90°
β	92.1 ± 0.009°
γ	90°
Cell volume	675.66 ± 0.09 Å³
Cell temperature	295 ± 0.2 K
Ambient diffraction temperature	295 ± 0.2 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	0.0619
Residual factor for significantly intense reflections	0.0363
Weighted residual factors for significantly intense reflections	0.066
Weighted residual factors for all reflections included in the refinement	0.0714
Goodness-of-fit parameter for all reflections included in the refinement	1.02
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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