Crystallography Open Database

Information card for entry 1560505

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Coordinates	1560505.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C25 H33 Cu2 N3 O5
Calculated formula	C25 H33 Cu2 N3 O5
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	27.1271 ± 0.0004 Å
b	10.7513 ± 0.0002 Å
c	21.5858 ± 0.0005 Å
α	90°
β	123.496 ± 0.0008°
γ	90°
Cell volume	5249.97 ± 0.18 Å³
Cell temperature	295 K
Ambient diffraction temperature	295 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	0.0654
Residual factor for significantly intense reflections	0.042
Weighted residual factors for significantly intense reflections	0.1074
Weighted residual factors for all reflections included in the refinement	0.1169
Goodness-of-fit parameter for all reflections included in the refinement	1.051
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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