Information card for entry 7132203

Structure parameters

• Formula: C68.5 H97.34 N8 O4 S20 Sn10
• Calculated formula: C68.5 H97.3333 N8 O4 S20 Sn10
• Title of publication: Selective and Benign Alkylation of Sulfido-Oxo Stannate Clusters with Propyl, Pentyl, or Hexyl Substituents
• Authors of publication: Stuhrmann, Gina; Schneider, Jannik; Schmidt, Kilian; Dehnen, Stefanie Susanne
• Journal of publication: Chemical Communications
• Year of publication: 2023
• a: 18.7606 ± 0.0017 Å
• b: 20.0088 ± 0.0019 Å
• c: 21.1091 ± 0.0019 Å
• α: 99.505 ± 0.007°
• β: 115.794 ± 0.007°
• γ: 110.29 ± 0.007°
• Cell volume: 6205.5 ± 1.3 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0822
• Residual factor for significantly intense reflections: 0.0456
• Weighted residual factors for significantly intense reflections: 0.123
• Weighted residual factors for all reflections included in the refinement: 0.1346
• Goodness-of-fit parameter for all reflections included in the refinement: 0.842
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54186 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No