Information card for entry 7704827

Structure parameters

• Formula: C70 H124 Ag4 N2 O39 Ti8
• Calculated formula: C74 H132 Ag4 N2 O39 Ti8
• Title of publication: Heterometallic Ag₂Ti₁₀ and Ag₄Ti₈-oxo clusters with different silver doping models: synthesis, structure, and theoretical studies.
• Authors of publication: Hou, Simin; Li, Qiaohong; Ding, Qing-Rong; Kang, Yao; Zhang, Jian; Zhang, Lei
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 31
• Pages of publication: 11005 - 11009
• a: 15.5445 ± 0.0003 Å
• b: 27.2039 ± 0.0006 Å
• c: 25.2746 ± 0.0006 Å
• α: 90°
• β: 100.439 ± 0.002°
• γ: 90°
• Cell volume: 10511 ± 0.4 ų
• Cell temperature: 100 ± 0.2 K
• Ambient diffraction temperature: 100 ± 0.2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.085
• Residual factor for significantly intense reflections: 0.0617
• Weighted residual factors for significantly intense reflections: 0.1625
• Weighted residual factors for all reflections included in the refinement: 0.1823
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No