Information card for entry 7033841

Structure parameters

• Formula: C36 H38 Cl2 N8 Ti2
• Calculated formula: C36 H38 Cl2 N8 Ti2
• SMILES: [cH]12[cH]3[cH]4[Ti]56713(Cl)([c]4([cH]25)C)N(C(N(C)C)=[N]7[Ti]12345([c]7([cH]1[cH]2[cH]3[cH]47)C)(N(C(N(C)C)=[N]65)c1cccc2cccnc12)Cl)c1cccc2cccnc12
• Title of publication: Inserted products of lithium silylquinolylamide dimers [{8-(2-R-C9H5N)N(Me3Si)}Li·OEt2]2 (R = H or Me) with dimethylcyanamide and their reactive derivatives with metal halides.
• Authors of publication: Wang, Peng; Li, Haifen; Xue, Xiaoyan; Chen, Xia
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 10
• Pages of publication: 4718 - 4725
• a: 9.3921 ± 0.0019 Å
• b: 18.774 ± 0.004 Å
• c: 12.411 ± 0.003 Å
• α: 90°
• β: 111.67 ± 0.03°
• γ: 90°
• Cell volume: 2033.7 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.069
• Residual factor for significantly intense reflections: 0.0605
• Weighted residual factors for significantly intense reflections: 0.1657
• Weighted residual factors for all reflections included in the refinement: 0.1704
• Goodness-of-fit parameter for all reflections included in the refinement: 1.13
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No