Information card for entry 7246465

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 ų
• 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 Fobs: No