Information card for entry 7034225

Structure parameters

• Formula: C12 H32 Cl4 O6 Sn Ti
• Calculated formula: C12 H32 Cl4 O6 Sn Ti
• SMILES: C(C)[O]1[Sn]([O](CC)[Ti]1([OH]CC)(OCC)(OCC)[OH]CC)(Cl)(Cl)(Cl)Cl
• Title of publication: A convenient and quantitative route to Sn(iv)-M [M = Ti(iv), Nb(v), Ta(v)] heterobimetallic precursors for dense mixed-metal oxide ceramics.
• Authors of publication: Mishra, Shashank; Jeanneau, Erwann; Mangematin, Stéphane; Chermette, Henry; Poor Kalhor, Mahboubeh; Bonnefont, Guillaume; Fantozzi, Gilbert; Le Floch, Sylvie; Pailhes, Stéphane; Daniele, Stéphane
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 15
• Pages of publication: 6848 - 6862
• a: 9.85 ± 0.001 Å
• b: 14.698 ± 0.002 Å
• c: 16.507 ± 0.002 Å
• α: 90.914 ± 0.009°
• β: 91.216 ± 0.009°
• γ: 96.418 ± 0.009°
• Cell volume: 2373.9 ± 0.5 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.123
• Residual factor for significantly intense reflections: 0.084
• Weighted residual factors for all reflections: 0.1899
• Weighted residual factors for significantly intense reflections: 0.1685
• Weighted residual factors for all reflections included in the refinement: 0.1899
• Goodness-of-fit parameter for all reflections included in the refinement: 0.9789
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No