Information card for entry 7007818

Structure parameters

• Formula: C15 H32 O4 Sn
• Calculated formula: C15 H32 O4 Sn
• Title of publication: Insertion reaction of carbon dioxide into Sn-OR bond. Synthesis, structure and DFT calculations of di- and tetranuclear isopropylcarbonato tin(IV) complexes.
• Authors of publication: Ballivet-Tkatchenko, Danielle; Chermette, Henry; Plasseraud, Laurent; Walter, Olaf
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2006
• Journal issue: 43
• Pages of publication: 5167 - 5175
• a: 8.5802 ± 0.0005 Å
• b: 10.4989 ± 0.0006 Å
• c: 10.5781 ± 0.0006 Å
• α: 88.505 ± 0.001°
• β: 79.441 ± 0.001°
• γ: 84.951 ± 0.001°
• Cell volume: 933.08 ± 0.09 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0206
• Residual factor for significantly intense reflections: 0.0189
• Weighted residual factors for significantly intense reflections: 0.0473
• Weighted residual factors for all reflections included in the refinement: 0.0482
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No