Information card for entry 1564124

Structure parameters

• Formula: C44 H60 N8 O4 Sn2
• Calculated formula: C44 H60 N8 O4 Sn2
• SMILES: C1C[N]2=Cc3cc(ccc3O[Sn]32([O]1[Sn]12([N](=Cc4cc(ccc4O2)/N=N/c2cccnc2)CC[O]31)(CCCC)CCCC)(CCCC)CCCC)/N=N/c1cccnc1
• Title of publication: Synthesis and structural characterization of diorganotin(IV) complexes with heteroditopic pyridyl-ONO′-ligands
• Authors of publication: Basu Baul, Tushar S.; Addepalli, Maheswara Rao; Lyčka, Antonin; van Terwingen, Steven; Fátima C. Guedes da Silva, M.
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2020
• Journal volume: 512
• Pages of publication: 119892
• a: 10.9058 ± 0.0003 Å
• b: 17.7727 ± 0.0004 Å
• c: 11.8279 ± 0.0003 Å
• α: 90°
• β: 108.35 ± 0.001°
• γ: 90°
• Cell volume: 2175.98 ± 0.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0368
• Residual factor for significantly intense reflections: 0.0284
• Weighted residual factors for significantly intense reflections: 0.0674
• Weighted residual factors for all reflections included in the refinement: 0.07
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No