Information card for entry 4063283

Structure parameters

• Formula: C33 H56 Ge N4 Ti3
• Calculated formula: C33 H56 Ge N4 Ti3
• SMILES: C[Ge](C)(C)N1[Ti]2345678([c]9([c]2([c]3([c]4([c]59C)C)C)C)C)N2[Ti]3459%1017([c]1([c]3([c]4([c]5([c]91C)C)C)C)C)N[Ti]134582%10([c]2([c]1([c]3([c]4([c]52C)C)C)C)C)N6
• Title of publication: Group 13 and 14 Alkyl Derivatives of the Imido-Nitrido Metalloligand [{Ti(η5-C5Me5)(μ-NH)}3(μ3-N)]
• Authors of publication: María García-Castro; Avelino Martín; Miguel Mena; Carlos Yélamos
• Journal of publication: Organometallics
• Year of publication: 2007
• Journal volume: 26
• Pages of publication: 408 - 416
• a: 11.029 ± 0.002 Å
• b: 17.9117 ± 0.0019 Å
• c: 19.7803 ± 0.0013 Å
• α: 111.658 ± 0.008°
• β: 90.192 ± 0.009°
• γ: 102.22 ± 0.011°
• Cell volume: 3535.1 ± 0.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0874
• Residual factor for significantly intense reflections: 0.0565
• Weighted residual factors for significantly intense reflections: 0.1405
• Weighted residual factors for all reflections included in the refinement: 0.1677
• Goodness-of-fit parameter for all reflections included in the refinement: 0.982
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No