Information card for entry 7016190

Structure parameters

• Formula: C96 H144 I4 Li8 N18 O15 Sn
• Calculated formula: C96 H144 I4 Li8 N18 O15 Sn
• Title of publication: Benzotriazolate cage complexes of tin(ii) and lithium: halide-influenced serendipitous assembly.
• Authors of publication: Sulway, Scott A.; Layfield, Richard A.; Bodensteiner, Michael; Scheuermayer, Sabine; Scheer, Manfred; Zabel, Manfred
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 29
• Pages of publication: 7559 - 7563
• a: 37.5021 ± 0.0005 Å
• b: 47.41 ± 0.0007 Å
• c: 12.6919 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 22565.9 ± 0.6 ų
• Cell temperature: 123 ± 1 K
• Ambient diffraction temperature: 123 ± 1 K
• Number of distinct elements: 7
• Space group number: 43
• Hermann-Mauguin space group symbol: F d d 2
• Hall space group symbol: F 2 -2d
• Residual factor for all reflections: 0.0359
• Residual factor for significantly intense reflections: 0.0352
• Weighted residual factors for significantly intense reflections: 0.0942
• Weighted residual factors for all reflections included in the refinement: 0.0947
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No