Information card for entry 7126317

Structure parameters

• Formula: C68 H77 N16 O S6 Sn4
• Calculated formula: C68 H77 N16 O S6 Sn4
• Title of publication: Trapping of ZnCl₂ by bipyridyl-functionalized organotin sulfide clusters, and its effect on optical properties.
• Authors of publication: Geringer, Eugenie; Leusmann, Eliza; Tambornino, Frank; Gerhard, Marina; Koch, Martin; Dehnen, Stefanie
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2020
• Journal volume: 56
• Journal issue: 35
• Pages of publication: 4769 - 4772
• a: 15.6802 ± 0.0003 Å
• b: 20.3433 ± 0.0003 Å
• c: 12.4505 ± 0.0002 Å
• α: 90°
• β: 109.194 ± 0.001°
• γ: 90°
• Cell volume: 3750.77 ± 0.11 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.0429
• Residual factor for significantly intense reflections: 0.0339
• Weighted residual factors for significantly intense reflections: 0.0834
• Weighted residual factors for all reflections included in the refinement: 0.0869
• Goodness-of-fit parameter for all reflections included in the refinement: 0.982
• Diffraction radiation wavelength: 1.54186 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No