Information card for entry 7012648

Structure parameters

• Formula: C32 H80 N8 Si4 Zr2
• Calculated formula: C32 H80 N8 Si4 Zr2
• SMILES: [Zr]12(N(C(C)C)[Si]([N]13C(C)C)(C)C)(N(C(C)C)[Si](N2C(C)C)(C)C)[N]([Zr]123N(C(C)C)[Si](N1C(C)C)(C)C)([Si](N2C(C)C)(C)C)C(C)C
• Title of publication: Synthesis and characterisation of novel zirconium(iv) derivatives containing the bis-amido ligand SiMe2(NRR')2
• Authors of publication: Passarelli, Vincenzo; Benetollo, Franco; Zanella, Pierino; Carta, Giovanni; Rossetto, Gilberto
• Journal of publication: Dalton Transactions
• Year of publication: 2003
• Journal issue: 7
• Pages of publication: 1411
• a: 10.033 ± 0.003 Å
• b: 46.986 ± 0.005 Å
• c: 10.498 ± 0.003 Å
• α: 90°
• β: 110.12 ± 0.03°
• γ: 90°
• Cell volume: 4647 ± 2 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/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0828
• Residual factor for significantly intense reflections: 0.0794
• Weighted residual factors for significantly intense reflections: 0.1771
• Weighted residual factors for all reflections included in the refinement: 0.1796
• Goodness-of-fit parameter for all reflections included in the refinement: 1.268
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No