Information card for entry 7708962

Structure parameters

• Chemical name: 4a
• Formula: C38 H66 N4 O2 Sn
• Calculated formula: C38 H66 N4 O2 Sn
• SMILES: [Sn]12(Oc3c(C[NH]1CCN(C)C)cc(cc3C(C)(C)C)C(C)(C)C)Oc1c(C[NH]2CCN(C)C)cc(cc1C(C)(C)C)C(C)(C)C
• Title of publication: Complexity of imine and amine Schiff-base tin(ii) complexes: drastic differences of amino and pyridyl side arms
• Authors of publication: Yimthachote, Supajittra; Chumsaeng, Phongnarin; Phomphrai, Khamphee
• Journal of publication: Dalton Transactions
• Year of publication: 2021
• a: 16.2871 ± 0.0011 Å
• b: 17.9609 ± 0.0011 Å
• c: 14.0251 ± 0.0009 Å
• α: 90°
• β: 103.863 ± 0.002°
• γ: 90°
• Cell volume: 3983.3 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• 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: 0.0235
• Residual factor for significantly intense reflections: 0.0197
• Weighted residual factors for significantly intense reflections: 0.0482
• Weighted residual factors for all reflections included in the refinement: 0.0498
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No