Information card for entry 7048223

Structure parameters

• Formula: C32 H56 O8 S4 Sn
• Calculated formula: C32 H56 O8 S4 Sn
• Title of publication: Spirocyclic tin salicyl alcoholates - a combined experimental and theoretical study on their structures, ¹¹⁹Sn NMR chemical shifts and reactivity in thermally induced twin polymerization.
• Authors of publication: Kitschke, Philipp; Preda, Ana-Maria; Auer, Alexander A.; Scholz, Sebastian; Rüffer, Tobias; Lang, Heinrich; Mehring, Michael
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 48
• Journal issue: 1
• Pages of publication: 220 - 230
• a: 9.0501 ± 0.0008 Å
• b: 9.8219 ± 0.0009 Å
• c: 11.8177 ± 0.0011 Å
• α: 72.18 ± 0.008°
• β: 73.284 ± 0.008°
• γ: 88.618 ± 0.007°
• Cell volume: 955.45 ± 0.16 ų
• Cell temperature: 110 K
• Ambient diffraction temperature: 110 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: 0.0233
• Residual factor for significantly intense reflections: 0.0233
• Weighted residual factors for significantly intense reflections: 0.0613
• Weighted residual factors for all reflections included in the refinement: 0.0613
• Goodness-of-fit parameter for all reflections included in the refinement: 1.104
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No