Information card for entry 7713561

Structure parameters

• Formula: C55 H74 Cl2 N4 O5 Ti2
• Calculated formula: C55 H74 Cl2 N4 O5 Ti2
• Title of publication: N-Aryloxide-Amidinate Group 4 Metal Complexes
• Authors of publication: Xu, Hanhua; Lv, Ze-Jie; Wei, Junnian; Xi, Zhenfeng
• Journal of publication: Dalton Transactions
• Year of publication: 2023
• a: 27.7408 ± 0.0008 Å
• b: 16.6115 ± 0.0004 Å
• c: 24.3585 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 11224.8 ± 0.5 ų
• Cell temperature: 180 ± 0.1 K
• Ambient diffraction temperature: 180 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 54
• Hermann-Mauguin space group symbol: P c c a
• Hall space group symbol: -P 2a 2ac
• Residual factor for all reflections: 0.0657
• Residual factor for significantly intense reflections: 0.052
• Weighted residual factors for significantly intense reflections: 0.1479
• Weighted residual factors for all reflections included in the refinement: 0.156
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No