Crystallography Open Database

Information card for entry 7061344

Preview

Coordinates	7061344.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C23 H21 Cu N3 O5
Calculated formula	C23 H21 Cu N3 O5
Title of publication	Structural diversity and magnetic properties of copper(ii) quinaldinate compounds with amino alcohols
Authors of publication	Podjed, Nina; Modec, Barbara; Clérac, Rodolphe; Rouzières, Mathieu; Alcaide, María M.; López-Serrano, Joaquín
Journal of publication	New Journal of Chemistry
Year of publication	2022
Journal volume	46
Journal issue	15
Pages of publication	6899 - 6920
a	19.2147 ± 0.0005 Å
b	7.9105 ± 0.0002 Å
c	14.0321 ± 0.0004 Å
α	90°
β	107.901 ± 0.003°
γ	90°
Cell volume	2029.6 ± 0.1 Å³
Cell temperature	150 ± 0.1 K
Ambient diffraction temperature	150 ± 0.1 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0341
Residual factor for significantly intense reflections	0.0307
Weighted residual factors for significantly intense reflections	0.0826
Weighted residual factors for all reflections included in the refinement	0.0852
Goodness-of-fit parameter for all reflections included in the refinement	1.056
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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