Information card for entry 1575811

Structure parameters

• Formula: C20 H34 F12 N4 O6 Ti2
• Calculated formula: C20 H34 F12 N4 O6 Ti2
• Title of publication: Exploring untapped potential of the molecular precursor approach to control fluorine-doping in mesostructured titania for acid catalysis
• Authors of publication: Elgayar, Fouad; Jeanneau, Erwann; Bargiela, Pascal; Mesbah, Adel; Essayem, Nadine; Mishra, Shashank
• Journal of publication: Catalysis Science & Technology
• Year of publication: 2025
• Journal volume: 15
• Journal issue: 22
• Pages of publication: 6744 - 6756
• a: 9.5425 ± 0.0002 Å
• b: 9.6023 ± 0.0002 Å
• c: 9.937 ± 0.0002 Å
• α: 67.895 ± 0.002°
• β: 79.245 ± 0.002°
• γ: 63.17 ± 0.002°
• Cell volume: 752.63 ± 0.03 ų
• Cell temperature: 100 ± 0.17 K
• Ambient diffraction temperature: 100 ± 0.17 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: 0.0332
• Residual factor for significantly intense reflections: 0.033
• Weighted residual factors for significantly intense reflections: 0.0918
• Weighted residual factors for all reflections included in the refinement: 0.092
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No