Information card for entry 4080888

Structure parameters

• Chemical name: Ti(N2O)(NC(ArF)NNPh)(py)2
• Formula: C39 H46 F5 N7 O Si2 Ti
• Calculated formula: C39 H46 F5 N7 O Si2 Ti
• SMILES: [Ti]12([O](CCN1[Si](C)(C)C)CCN2[Si](C)(C)C)(=NC(=NN(c1ccccc1)c1ccccc1)c1c(F)c(F)c(F)c(F)c1F)([n]1ccccc1)[n]1ccccc1
• Title of publication: Synthesis and Reactivity of Titanium Hydrazido Complexes Supported by Diamido-Ether Ligands
• Authors of publication: Unruangsri, Junjuda; Morgan, Hannah; Schwarz, Andrew D.; Schofield, A. Daniel; Mountford, Philip
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 10
• Pages of publication: 3091
• a: 37.6557 ± 0.0004 Å
• b: 11.8874 ± 0.0001 Å
• c: 18.5197 ± 0.0002 Å
• α: 90°
• β: 97.1298 ± 0.0005°
• γ: 90°
• Cell volume: 8225.84 ± 0.14 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1085
• Residual factor for significantly intense reflections: 0.0476
• Weighted residual factors for all reflections: 0.095
• Weighted residual factors for significantly intense reflections: 0.0465
• Weighted residual factors for all reflections included in the refinement: 0.0412
• Goodness-of-fit parameter for all reflections included in the refinement: 1.111
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No