Crystallography Open Database

Information card for entry 7246465

Preview

Coordinates	7246465.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H26 Co N4 O4
Calculated formula	C28 H26 Co N4 O4
SMILES	[Co]12(Oc3c(C=[N]1c1ncc(cc1)C)cccc3OC)Oc1c(OC)cccc1C=[N]2c1ncc(cc1)C
Title of publication	Reactions of cobalt(ii) chloride and cobalt(ii) acetate with hemisalen-type ligands: ligand transformation, oxidation of cobalt and complex formation. Preliminary study on the cytotoxicity of Co(ii) and Co(iii) hemisalen complexes
Authors of publication	Siedzielnik, Magdalena; Pawłowska, Monika; Daśko, Mateusz; Kleinschmidt, Hubert; Dołęga, Anna
Journal of publication	RSC Advances
Year of publication	2023
Journal volume	13
Journal issue	13
Pages of publication	8830 - 8843
a	13.6519 ± 0.0004 Å
b	13.7225 ± 0.0005 Å
c	26.126 ± 0.0008 Å
α	90°
β	90.899 ± 0.003°
γ	90°
Cell volume	4893.8 ± 0.3 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.106
Residual factor for significantly intense reflections	0.0556
Weighted residual factors for significantly intense reflections	0.1072
Weighted residual factors for all reflections included in the refinement	0.1288
Goodness-of-fit parameter for all reflections included in the refinement	1.027
Diffraction radiation probe	x-ray
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
281927 (current)	2023-03-17	cif/ Adding structures of 7246459, 7246460, 7246461, 7246462, 7246463, 7246464, 7246465 via cif-deposit CGI script.	7246465.cif