Information card for entry 7034967

Structure parameters

• Formula: C20 H24 O4 Sn
• Calculated formula: C20 H24 O4 Sn
• SMILES: [Sn]12(OC(=[O]1)c1cc(cc(c1)C)C)(OC(=[O]2)c1cc(cc(c1)C)C)(C)C
• Title of publication: Organotin(iv) based anti-HCV drugs: synthesis, characterization and biochemical activity.
• Authors of publication: Shah, Farooq Ali; Sabir, Shaista; Fatima, Kaneez; Ali, Saqib; Qadri, Ishtiaq; Rizzoli, Corrado
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 22
• Pages of publication: 10467 - 10478
• a: 11.54 ± 0.004 Å
• b: 7.298 ± 0.002 Å
• c: 24.778 ± 0.008 Å
• α: 90°
• β: 102.918 ± 0.005°
• γ: 90°
• Cell volume: 2034 ± 1.1 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 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: 0.0312
• Residual factor for significantly intense reflections: 0.0267
• Weighted residual factors for significantly intense reflections: 0.0678
• Weighted residual factors for all reflections included in the refinement: 0.071
• Goodness-of-fit parameter for all reflections included in the refinement: 1.097
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No