Crystallography Open Database

Information card for entry 1560506

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Coordinates	1560506.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H26 Cu2 N2 O4
Calculated formula	C22 H26 Cu2 N2 O4
Title of publication	Structural and magnetic characterization of three tetranuclear Cu(II) complexes with face-sharing-dicubane/double-open-cubane like core framework
Authors of publication	Paul, Aparup; Bertolasi, Valerio; Figuerola, Albert; Manna, Subal Chandra
Journal of publication	Journal of Solid State Chemistry
Year of publication	2017
Journal volume	249
Pages of publication	29 - 38
a	8.751 ± 0.0004 Å
b	11.3271 ± 0.0005 Å
c	12.3969 ± 0.0006 Å
α	105.063 ± 0.002°
β	97.907 ± 0.002°
γ	106.441 ± 0.0016°
Cell volume	1108.12 ± 0.09 Å³
Cell temperature	295 K
Ambient diffraction temperature	295 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0648
Residual factor for significantly intense reflections	0.0475
Weighted residual factors for significantly intense reflections	0.1343
Weighted residual factors for all reflections included in the refinement	0.1522
Goodness-of-fit parameter for all reflections included in the refinement	1.027
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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