Information card for entry 7716005

Structure parameters

• Formula: C40 H38 Cl2 N6 O12 Zn
• Calculated formula: C40 H38 Cl2 N6 O12 Zn
• Title of publication: The effect of ionic <i>versus</i> covalent functionalization of polyoxometalate hybrid materials with coordinating subunits on their stability and interaction with DNA.
• Authors of publication: Nowicka, Daria; Marcinkowski, Dawid; Vadra, Nahir; Szymańska, Martyna; Kubicki, Maciej; Consiglio, Giuseppe; Drożdż, Wojciech; Stefankiewicz, Artur R.; Patroniak, Violetta; Fik-Jaskółka, Marta; Gorczyński, Adam
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 28
• Pages of publication: 11678 - 11688
• a: 12.9401 ± 0.0008 Å
• b: 13.1181 ± 0.0008 Å
• c: 13.9436 ± 0.0006 Å
• α: 68.923 ± 0.005°
• β: 80.861 ± 0.004°
• γ: 66.577 ± 0.006°
• Cell volume: 2026.2 ± 0.2 ų
• Cell temperature: 100 ± 1 K
• Ambient diffraction temperature: 100 ± 1 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0923
• Residual factor for significantly intense reflections: 0.0775
• Weighted residual factors for significantly intense reflections: 0.199
• Weighted residual factors for all reflections included in the refinement: 0.2085
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No