Information card for entry 7133386

Structure parameters

• Formula: C212 H132 Ag2 N4 O36 P4 Ti4
• Calculated formula: C212 H132 Ag2 N4 O36 P4 Ti4
• Title of publication: Combining Ti₄(embonate)₆ anionic cages and π-conjugated coordination cations for highly effective optical limiting.
• Authors of publication: Yuan, Yuan; Zhang, Dong-Hui; Li, Qiao-Hong; Chen, Shu-Mei; He, Yan-Ping; Zhang, Jian
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2024
• Journal volume: 60
• Journal issue: 66
• Pages of publication: 8748 - 8751
• a: 20.4503 ± 0.0004 Å
• b: 20.4503 ± 0.0004 Å
• c: 54.8956 ± 0.0015 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 22958.2 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 92
• Hermann-Mauguin space group symbol: P 41 21 2
• Hall space group symbol: P 4abw 2nw
• Residual factor for all reflections: 0.1207
• Residual factor for significantly intense reflections: 0.059
• Weighted residual factors for significantly intense reflections: 0.1631
• Weighted residual factors for all reflections included in the refinement: 0.202
• Goodness-of-fit parameter for all reflections included in the refinement: 0.933
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No