Information card for entry 7037957

Structure parameters

• Formula: C39 H63 Li3 N3 O6 P Si3
• Calculated formula: C39 H63 Li3 N3 O6 P Si3
• Title of publication: Cyclometalated titanium and zirconium complexes stabilised by a new silylmethylene-linked tetradentate triamidophosphine.
• Authors of publication: Sietzen, M.; Federmann, P.; Sonnenschein, C.; Wadepohl, H.; Ballmann, J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 7
• Pages of publication: 3013 - 3023
• a: 12.4277 ± 0.0002 Å
• b: 13.1483 ± 0.0002 Å
• c: 14.8044 ± 0.0003 Å
• α: 106.964 ± 0.0016°
• β: 92.2955 ± 0.0016°
• γ: 98.2181 ± 0.0015°
• Cell volume: 2281.51 ± 0.07 ų
• Cell temperature: 110 ± 1 K
• Ambient diffraction temperature: 110 ± 1 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0773
• Residual factor for significantly intense reflections: 0.0598
• Weighted residual factors for significantly intense reflections: 0.1485
• Weighted residual factors for all reflections included in the refinement: 0.1576
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No