Information card for entry 4073536

Structure parameters

• Formula: C22 H25 Cl5 Sb2
• Calculated formula: C24 H25 Cl5 Sb2
• SMILES: Cc1cc(C)cc(C)c1c1c([Sb](Cl)Cl)c(ccc1)c1c(cc(cc1C)C)C.[Sb](Cl)(Cl)Cl
• Title of publication: The First Mixed-Valent Antimony(III/V) Oxo Clusters (2,6-Mes2C6H3Sb)2(ClSb)4O8and (2,6-Mes2C6H3Sb)4(ClSb)4(HOSb)2O14†
• Authors of publication: Beckmann, Jens; Heek, Timm; Takahashi, Masashi
• Journal of publication: Organometallics
• Year of publication: 2007
• Journal volume: 26
• Journal issue: 15
• Pages of publication: 3633
• a: 38.306 ± 0.006 Å
• b: 8.7273 ± 0.0014 Å
• c: 24.836 ± 0.004 Å
• α: 90°
• β: 99.759 ± 0.004°
• γ: 90°
• Cell volume: 8183 ± 2 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1371
• Residual factor for significantly intense reflections: 0.0787
• Weighted residual factors for significantly intense reflections: 0.1833
• Weighted residual factors for all reflections included in the refinement: 0.2142
• Goodness-of-fit parameter for all reflections included in the refinement: 0.966
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No