Information card for entry 7220206

Structure parameters

• Common name: [(2,2'-bipyridine)di(oxolinicato-κ^2^O,O)cobalt(II)] tris methanol solvate
• Chemical name: [(2,2'-bipyridine)di(5-ethyl-8-oxo-5,8-dihydro-[1,3]dioxolo[4,5-g]quinoline-7-carboxylato-κ^2^O,O)cobalt(II)] tris methanol solvate
• Formula: C39 H40 Co N4 O13
• Calculated formula: C39 H40 Co N4 O13
• SMILES: [Co]123([O]=c4c5cc6OCOc6cc5n(cc4C(=O)O2)CC)([O]=c2c(cn(c4c2cc2OCOc2c4)CC)C(=O)O1)[n]1c(cccc1)c1[n]3cccc1.CO.OC.CO
• Title of publication: Cobalt(II) complexes with quinolone antimicrobial drug oxolinic acid: Structure and biological perspectives
• Authors of publication: Irgi, Eugenia; Geromichalos, Georges; Balala, Sofia; Kljun, Jakob; Kalogiannis, Stavros; Papadopoulos, Athanasios; Turel, Iztok; Psomas, George L.
• Journal of publication: RSC Adv.
• Year of publication: 2015
• a: 10.2466 ± 0.0004 Å
• b: 13.8031 ± 0.0006 Å
• c: 14.1851 ± 0.0005 Å
• α: 105.164 ± 0.002°
• β: 101.176 ± 0.002°
• γ: 96.925 ± 0.002°
• Cell volume: 1868.36 ± 0.13 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1239
• Residual factor for significantly intense reflections: 0.0793
• Weighted residual factors for significantly intense reflections: 0.2191
• Weighted residual factors for all reflections included in the refinement: 0.2462
• Goodness-of-fit parameter for all reflections included in the refinement: 1.118
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No