Information card for entry 7034228

Structure parameters

• Formula: C16 H39 Cl4 Nb O6 Sn
• Calculated formula: C16 H39 Cl4 Nb O6 Sn
• SMILES: C(C)[O]1[Sn]([O](CC)[Nb]1(OC(C)C)(OC(C)C)(OC(C)C)[OH]C(C)C)(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: 9.9442 ± 0.0007 Å
• b: 14.616 ± 0.001 Å
• c: 18.675 ± 0.002 Å
• α: 90°
• β: 99.107 ± 0.008°
• γ: 90°
• Cell volume: 2680.1 ± 0.4 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: 0.0836
• Residual factor for significantly intense reflections: 0.0562
• Weighted residual factors for all reflections: 0.1838
• Weighted residual factors for significantly intense reflections: 0.1669
• Weighted residual factors for all reflections included in the refinement: 0.1838
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0282
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No