Information card for entry 4079041

Structure parameters

• Formula: C19 H14 Al Cl3 P2 S2 Sn
• Calculated formula: C19 H14 Al Cl3 P2 S2 Sn
• SMILES: [Al](C12[Sn]3[S]=P1(c1ccccc1)c1ccccc1P2(c1ccccc1)=[S]3)(Cl)(Cl)Cl
• Title of publication: Synthesis of a Tin(II) 1,3-Benzobis(thiophosphinoyl)methanediide Complex and Its Reactions with Aluminum Compounds
• Authors of publication: Yang, Yi-Fan; Foo, Cechao; Ganguly, Rakesh; Li, Yongxin; So, Cheuk-Wai
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 18
• Pages of publication: 6538
• a: 8.603 ± 0.0004 Å
• b: 16.4257 ± 0.0007 Å
• c: 16.4348 ± 0.0007 Å
• α: 90°
• β: 96.09 ± 0.002°
• γ: 90°
• Cell volume: 2309.3 ± 0.18 ų
• Cell temperature: 103 ± 2 K
• Ambient diffraction temperature: 103 ± 2 K
• Number of distinct elements: 7
• 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: 0.061
• Residual factor for significantly intense reflections: 0.0402
• Weighted residual factors for significantly intense reflections: 0.0993
• Weighted residual factors for all reflections included in the refinement: 0.1192
• Goodness-of-fit parameter for all reflections included in the refinement: 1.093
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No