Information card for entry 7006228

Structure parameters

• Formula: C65 H90 Cl2 N4 O2 Ti2
• Calculated formula: C65 H90 Cl2 N4 O2 Ti2
• Title of publication: A ligand influence on the stability of heterobimetallic complexes containing the Ti(µ-O)Al skeleton. Transformation of heterometallic systems to the homometallic Ti(iv) and Al(iii) complexes
• Authors of publication: Nikiforov, Grigory B.; Roesky, Herbert W.; Jones, Peter G.; Oswald, Rainer B.; Noltemeyer, Mathias
• Journal of publication: Dalton Transactions
• Year of publication: 2007
• Journal issue: 37
• Pages of publication: 4149
• a: 13.4999 ± 0.0018 Å
• b: 12.9944 ± 0.0016 Å
• c: 17.35 ± 0.002 Å
• α: 90°
• β: 101.761 ± 0.005°
• γ: 90°
• Cell volume: 2979.7 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.045
• Residual factor for significantly intense reflections: 0.0332
• Weighted residual factors for significantly intense reflections: 0.0814
• Weighted residual factors for all reflections included in the refinement: 0.0875
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No