Information card for entry 7244892

Structure parameters

• Formula: C48 H50 Cu2 N6 O12
• Calculated formula: C48 H50 Cu2 N6 O12
• Title of publication: Template synthesis, DNA binding, antimicrobial activity, Hirshfeld surface analysis, and 1D helical supramolecular structure of a novel binuclear copper(ii) Schiff base complex
• Authors of publication: Goudarziafshar, Hamid; Yousefi, Somaieh; Abbasi Tyula, Yunes; Dušek, Michal; Eigner, Václav
• Journal of publication: RSC Advances
• Year of publication: 2022
• Journal volume: 12
• Journal issue: 22
• Pages of publication: 13580 - 13592
• a: 8.3185 ± 0.0004 Å
• b: 17.6483 ± 0.0007 Å
• c: 15.7257 ± 0.0008 Å
• α: 90°
• β: 101.951 ± 0.004°
• γ: 90°
• Cell volume: 2258.61 ± 0.18 ų
• Cell temperature: 120 ± 0.1 K
• Ambient diffraction temperature: 120 K
• Number of distinct elements: 5
• 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: 0.0455
• Residual factor for significantly intense reflections: 0.0414
• Weighted residual factors for significantly intense reflections: 0.1112
• Weighted residual factors for all reflections included in the refinement: 0.1138
• Goodness-of-fit parameter for significantly intense reflections: 1.83
• Goodness-of-fit parameter for all reflections included in the refinement: 1.77
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No