Crystallography Open Database

Information card for entry 1563799

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Coordinates	1563799.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H28 Cl6 Cu2 N2 O12
Calculated formula	C30 H28 Cl6 Cu2 N2 O12
SMILES	[Cu]1234[N](=Cc5c(O4)cccc5)C[C@@H]([O]2[Cu]241Oc1ccccc1C=[N]4C[C@@H]([O]32)[C@H]1O[C@@H]2O[C@@H](O[C@@H]2[C@H]1O)C(Cl)(Cl)Cl)[C@H]1O[C@@H]2O[C@@H](O[C@@H]2[C@H]1O)C(Cl)(Cl)Cl
Title of publication	Synthesis, characterization and biological application of dinuclear Cu(II) complexes of Schiff base ligands of galactochloralose and α-chloralose
Authors of publication	Salman, Yeşim; Barlas, Fırat Barış; Yavuz, Murat; Kaya, Kerem; Timur, Suna; Telli, Fatma Çetin
Journal of publication	Inorganica Chimica Acta
Year of publication	2018
Journal volume	483
Pages of publication	98 - 105
a	12.8223 ± 0.0013 Å
b	12.8239 ± 0.0009 Å
c	38.138 ± 0.003 Å
α	89.966 ± 0.002°
β	89.948 ± 0.003°
γ	60.027 ± 0.002°
Cell volume	5432.4 ± 0.8 Å³
Cell temperature	297 ± 2 K
Ambient diffraction temperature	297 ± 2 K
Number of distinct elements	6
Space group number	1
Hermann-Mauguin space group symbol	P 1
Hall space group symbol	P 1
Residual factor for all reflections	0.2072
Residual factor for significantly intense reflections	0.0862
Weighted residual factors for significantly intense reflections	0.1644
Weighted residual factors for all reflections included in the refinement	0.2086
Goodness-of-fit parameter for all reflections included in the refinement	1.07
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
266813 (current)	2021-06-30	cif/ Adding structures of 1563799 via cif-deposit CGI script.	1563799.cif