Information card for entry 7032688

Structure parameters

• Formula: C28 H50 Li2 N4 O2 S2
• Calculated formula: C28 H50 Li2 N4 O2 S2
• Title of publication: Lithiated sulfoxides: α-sulfinyl functionalized carbanions.
• Authors of publication: Ludwig, Gerd; Rüffer, Tobias; Hoppe, André; Walther, Till; Lang, Heinrich; Ebbinghaus, Stefan G.; Steinborn, Dirk
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 12
• Pages of publication: 5323 - 5330
• a: 19.731 ± 0.003 Å
• b: 9.3082 ± 0.0011 Å
• c: 19.687 ± 0.003 Å
• α: 90°
• β: 112.117 ± 0.016°
• γ: 90°
• Cell volume: 3349.7 ± 0.9 ų
• Cell temperature: 110 K
• Ambient diffraction temperature: 110 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.152
• Residual factor for significantly intense reflections: 0.0996
• Weighted residual factors for significantly intense reflections: 0.2687
• Weighted residual factors for all reflections included in the refinement: 0.3157
• Goodness-of-fit parameter for all reflections included in the refinement: 0.976
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No