Information card for entry 2235588

Structure parameters

• Chemical name: <i>n</i>-Butyldichlorido{4-cyclohexyl-1-[1-(pyridin-2-yl- κ<i>N</i>)ethylidene]thiosemicarbazidato-κ^2^<i>N</i>^1^,<i>S</i>}tin(IV)
• Formula: C18 H28 Cl2 N4 S Sn
• Calculated formula: C18 H28 Cl2 N4 S Sn
• SMILES: [Sn]12(Cl)(Cl)(SC(=N[N]2=C(c2[n]1cccc2)C)NC1CCCCC1)CCCC
• Title of publication: <i>n</i>-Butyldichlorido{4-cyclohexyl-1-[1-(pyridin-2-yl-κ<i>N</i>)ethylidene]thiosemicarbazidato-κ^2^<i>N</i>^1^,<i>S</i>}tin(IV)
• Authors of publication: Affan, Md. Abu; Salam, Md. Abdus; Asaruddin, Mohd Razip; Ng, Seik Weng; Tiekink, Edward R. T.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 7
• Pages of publication: m909 - m910
• a: 12.1229 ± 0.0003 Å
• b: 15.4518 ± 0.0004 Å
• c: 23.6868 ± 0.0006 Å
• α: 90°
• β: 103.894 ± 0.003°
• γ: 90°
• Cell volume: 4307.2 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.044
• Residual factor for significantly intense reflections: 0.0347
• Weighted residual factors for significantly intense reflections: 0.0792
• Weighted residual factors for all reflections included in the refinement: 0.0851
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes