Information card for entry 2230240

Structure parameters

• Chemical name: Bis{μ-2-[(<i>N</i>,<i>N</i>-diisopropylcarbamothioyl)sulfanyl]acetato- κ^2^<i>O</i>:<i>O</i>'}bis(bis(4-chlorobenzyl){2-[(<i>N</i>,<i>N</i>- diisopropylcarbamothioyl)sulfanyl]acetato-κ^2^<i>O</i>,<i>O</i>'}tin(IV))
• Formula: C64 H88 Cl4 N4 O8 S8 Sn2
• Calculated formula: C64 H88 Cl4 N4 O8 S8 Sn2
• SMILES: C(c1ccc(cc1)Cl)[Sn]12(Cc3ccc(cc3)Cl)(OC(=[O]1)CSC(=S)N(C(C)C)C(C)C)OC(=[O][Sn]1(Cc3ccc(cc3)Cl)(Cc3ccc(cc3)Cl)(OC(=[O]1)CSC(=S)N(C(C)C)C(C)C)OC(=[O]2)CSC(=S)N(C(C)C)C(C)C)CSC(=S)N(C(C)C)C(C)C
• Title of publication: Bis{μ-2-[(<i>N</i>,<i>N</i>-diisopropylcarbamothioyl)sulfanyl]acetato-κ^2^<i>O</i>:<i>O</i>'}bis(bis(4-chlorobenzyl){2-[(<i>N</i>,<i>N</i>-diisopropylcarbamothioyl)sulfanyl]acetato-κ^2^<i>O</i>,<i>O</i>'}tin(IV))
• Authors of publication: Keng, Thy Chun; Lo, Kong Mun; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 6
• Pages of publication: m661
• a: 11.0257 ± 0.0001 Å
• b: 13.1588 ± 0.0002 Å
• c: 14.5369 ± 0.0002 Å
• α: 96.4464 ± 0.0005°
• β: 101.066 ± 0.0005°
• γ: 112.817 ± 0.0005°
• Cell volume: 1866.82 ± 0.04 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.027
• Residual factor for significantly intense reflections: 0.0244
• Weighted residual factors for significantly intense reflections: 0.0796
• Weighted residual factors for all reflections included in the refinement: 0.0834
• Goodness-of-fit parameter for all reflections included in the refinement: 0.932
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes