Information card for entry 7701177

Structure parameters

• Common name: [CuL30fBr]
• Formula: C36 H34 Br2 Cu2 N4 O6
• Calculated formula: C36 H34 Br2 Cu2 N4 O6
• Title of publication: Copper(ii) complexes with tridentate Schiff base-like ligands: solid state and solution structures and anticancer activity.
• Authors of publication: Dankhoff, Katja; Gold, Madeleine; Kober, Luisa; Schmitt, Florian; Pfeifer, Lena; Dürrmann, Andreas; Kostrhunova, Hana; Rothemund, Matthias; Brabec, Viktor; Schobert, Rainer; Weber, Birgit
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 40
• Pages of publication: 15220 - 15230
• a: 10.5383 ± 0.0006 Å
• b: 9.5476 ± 0.0005 Å
• c: 17.4636 ± 0.0012 Å
• α: 90°
• β: 100.791 ± 0.005°
• γ: 90°
• Cell volume: 1726.04 ± 0.18 ų
• Cell temperature: 133 ± 2 K
• Ambient diffraction temperature: 133 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1115
• Residual factor for significantly intense reflections: 0.0733
• Weighted residual factors for significantly intense reflections: 0.1886
• Weighted residual factors for all reflections included in the refinement: 0.2261
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No