Information card for entry 7716093

Structure parameters

• Formula: C114 H134 Cl2 Co2 N16 O20
• Calculated formula: C104 H104 Cl2 Co2 N14 O14
• Title of publication: Repurposing the antihistamine drug bilastine as an anti-cancer metallic drug entity: synthesis and single-crystal X-ray structure analysis of metal-based bilastine and phen [Co(II), Cu(II) and Zn(II)] tailored anticancer chemotherapeutic agents against resistant cancer cells.
• Authors of publication: Rijwan, ?; Arjmand, Farukh; Tabassum, Sartaj
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 24
• Pages of publication: 10126 - 10141
• a: 13.8983 ± 0.001 Å
• b: 13.9966 ± 0.001 Å
• c: 15.2105 ± 0.001 Å
• α: 90°
• β: 111.999 ± 0.008°
• γ: 90°
• Cell volume: 2743.4 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 7
• Hermann-Mauguin space group symbol: P 1 n 1
• Hall space group symbol: P -2yac
• Residual factor for all reflections: 0.0864
• Residual factor for significantly intense reflections: 0.055
• Weighted residual factors for significantly intense reflections: 0.1345
• Weighted residual factors for all reflections included in the refinement: 0.1506
• Goodness-of-fit parameter for all reflections included in the refinement: 0.9623
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No