Information card for entry 4315007

Structure parameters

• Formula: C37 H46 Cl4 N4 Ti
• Calculated formula: C37 H46 Cl4 N4 Ti
• Title of publication: Steric Control of Coordination Geometry in Titanium-Imido Complexes of N,N'-bis(arylimino)acenaphthylene Ligands
• Authors of publication: Kensha Marie Clark; Joseph W. Ziller; Alan F. Heyduk
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 2222 - 2231
• a: 12.1324 ± 0.0017 Å
• b: 13.1859 ± 0.0018 Å
• c: 13.2874 ± 0.0019 Å
• α: 104.719 ± 0.003°
• β: 112.632 ± 0.002°
• γ: 92.344 ± 0.003°
• Cell volume: 1874.6 ± 0.5 ų
• Cell temperature: 158 ± 2 K
• Ambient diffraction temperature: 158 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0692
• Residual factor for significantly intense reflections: 0.0588
• Weighted residual factors for significantly intense reflections: 0.1474
• Weighted residual factors for all reflections included in the refinement: 0.1548
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No