Information card for entry 7109525

Structure parameters

• Formula: C70 H79 Br8 Cl5 N16 S10 Sn4 Zn8
• Calculated formula: C70 H79 Br8 Cl5 N16 S10 Sn4 Zn8
• Title of publication: Towards the installation of transition metal ions on donor ligand decorated tin sulfide clusters
• Authors of publication: Beatrix E. K. Barth; Eliza Leusmann; Klaus Harms; Stefanie Dehnen
• Journal of publication: Chem.Commun.
• Year of publication: 2013
• Journal volume: 49
• Pages of publication: 6590
• a: 16.0625 ± 0.0011 Å
• b: 18.7495 ± 0.001 Å
• c: 20.2991 ± 0.0012 Å
• α: 85.537 ± 0.005°
• β: 70.132 ± 0.005°
• γ: 70.846 ± 0.005°
• Cell volume: 5427.3 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1551
• Residual factor for significantly intense reflections: 0.0589
• Weighted residual factors for significantly intense reflections: 0.0938
• Weighted residual factors for all reflections included in the refinement: 0.1188
• Goodness-of-fit parameter for all reflections included in the refinement: 0.863
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No