Information card for entry 7006199

Structure parameters

• Formula: C18 H32 N4 S Si Ti
• Calculated formula: C18 H32 N4 S Si Ti
• SMILES: [Ti]12345(N(c6sccn6)[Si]([c]26[c]3([c]4([c]5([c]61C)C)C)C)(C)C)(N(C)C)N(C)C
• Title of publication: Synthesis, characterization and reactivity of new complexes of titanium and zirconium containing a potential tridentate amidinato-cyclopentadienyl ligand.
• Authors of publication: Bertolasi, Valerio; Boaretto, Rita; Chierotti, Michele R.; Gobetto, Roberto; Sostero, Silvana
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2007
• Journal issue: 44
• Pages of publication: 5179 - 5189
• a: 9.8186 ± 0.0002 Å
• b: 17.3817 ± 0.0004 Å
• c: 12.8635 ± 0.0003 Å
• α: 90°
• β: 100.87 ± 0.001°
• γ: 90°
• Cell volume: 2155.95 ± 0.08 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0813
• Residual factor for significantly intense reflections: 0.0428
• Weighted residual factors for significantly intense reflections: 0.0924
• Weighted residual factors for all reflections included in the refinement: 0.1028
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No