Information card for entry 4301958

Structure parameters

• Formula: C24 H68 O20 P4 S2 Sn4
• Calculated formula: C24 H68 O20 P4 S2 Sn4
• SMILES: C(C)[Sn]12(CC)[O]=P(C)(O[Sn](CC)(CC)([O]=P(O2)(O)C)OS(=O)(=O)CC)O[Sn]2(CC)(CC)[O]=P(C)(O[Sn](CC)(CC)([O]=P(O2)(O)C)OS(=O)(=O)CC)O1.O.O
• Title of publication: Facile Synthesis of Novel Two- And Three-Dimensional Coordination Polymers Containing Dialkyltin Phosphonate-Based Tri/Tetra-Nuclear Clusters with Appended Sulfonate Groups
• Authors of publication: Ravi Shankar; Archana Jain; Atul Pratap Singh; Gabriele Kociok-Köhn; Kieran C. Molloy
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 3608 - 3616
• a: 8.3684 ± 0.0003 Å
• b: 9.8461 ± 0.0004 Å
• c: 14.8985 ± 0.0006 Å
• α: 77.665 ± 0.002°
• β: 87.625 ± 0.002°
• γ: 87.683 ± 0.002°
• Cell volume: 1197.58 ± 0.08 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 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: 0.0383
• Residual factor for significantly intense reflections: 0.0318
• Weighted residual factors for significantly intense reflections: 0.0754
• Weighted residual factors for all reflections included in the refinement: 0.0795
• Goodness-of-fit parameter for all reflections included in the refinement: 1.15
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No