Crystallography Open Database

Information card for entry 7241396

Preview

Coordinates	7241396.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H36 Cu2 N10 O4 Zn
Calculated formula	C40 H36 Cu2 N10 O4 Zn
Title of publication	Recurrent π(arene)•••π(chelate ring) motifs in four trinuclear CuII2MII (M = Cd/Zn) complexes derived from an unsymmetrical N2O2 donor ligand: structural and theoretical investigations
Authors of publication	Maity, Souvik; Ghosh, Tanmoy Kumar; Gomila, Rosa Maria; Frontera, Antonio; Ghosh, Ashutosh
Journal of publication	CrystEngComm
Year of publication	2020
a	25.0469 ± 0.0004 Å
b	10.1507 ± 0.0002 Å
c	16.1021 ± 0.0003 Å
α	90°
β	100.547 ± 0.001°
γ	90°
Cell volume	4024.69 ± 0.13 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
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	0.0643
Residual factor for significantly intense reflections	0.0508
Weighted residual factors for significantly intense reflections	0.165
Weighted residual factors for all reflections included in the refinement	0.1767
Goodness-of-fit parameter for all reflections included in the refinement	1.43
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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