Information card for entry 4322434

Structure parameters

• Formula: C110 H240 Cl2 Li20 N16 O28 S8
• Calculated formula: C110 H240 Cl2 Li20 N16 O28 S8
• Title of publication: Template Effects of Lithium Salts on the Crystallization of Diazasulfates: X-ray Structures of {THF.Li2[O2S(NtBu)2]}8.2LiOH.2LiCl and {(THF.Li)2[O2S(NtBu)2].(THF)LiCl}2
• Authors of publication: Justin K. Brask; Tristram Chivers; Glenn P. A. Yap
• Journal of publication: Inorganic Chemistry
• Year of publication: 1999
• Journal volume: 38
• Pages of publication: 5588 - 5592
• a: 18.557 ± 0.0012 Å
• b: 15.7307 ± 0.001 Å
• c: 28.0629 ± 0.0018 Å
• α: 90°
• β: 107.381 ± 0.001°
• γ: 90°
• Cell volume: 7817.9 ± 0.9 ų
• Cell temperature: 203 ± 2 K
• Ambient diffraction temperature: 203 ± 2 K
• Number of distinct elements: 7
• 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: 0.0819
• Residual factor for significantly intense reflections: 0.0554
• Weighted residual factors for significantly intense reflections: 0.1575
• Weighted residual factors for all reflections included in the refinement: 0.1718
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No