Information card for entry 7133387

Structure parameters

• Formula: C294 H224 Ag8 N8 O36 P8 Ti4
• Calculated formula: C294 H224 Ag8 N8 O36 P8 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: 35.6145 ± 0.0004 Å
• b: 22.6414 ± 0.0002 Å
• c: 47.7519 ± 0.0007 Å
• α: 90°
• β: 110.16 ± 0.002°
• γ: 90°
• Cell volume: 36146.3 ± 0.9 ų
• Cell temperature: 99.99 ± 0.1 K
• Ambient diffraction temperature: 99.99 ± 0.1 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Residual factor for all reflections: 0.129
• Residual factor for significantly intense reflections: 0.109
• Weighted residual factors for significantly intense reflections: 0.2924
• Weighted residual factors for all reflections included in the refinement: 0.312
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.3405 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No