Information card for entry 4078228

Structure parameters

• Formula: C41 H46 N2 O P2 S Si Sn
• Calculated formula: C41 H46 N2 O P2 S Si Sn
• SMILES: [Sn]12N(C(=O)C(P(c3ccccc3)(c3ccccc3)=[S]2)=P(c2ccccc2)(c2ccccc2)N1[Si](C)(C)C)c1c(C(C)C)cccc1C(C)C
• Title of publication: Reactivity of a Tin(II) (Iminophosphinoyl)(thiophosphinoyl)methanediide Complex toward Isocyanates and Rhodium(I) Chloride
• Authors of publication: Guo, Jia-Yi; Li, Yongxin; Ganguly, Rakesh; So, Cheuk-Wai
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 10
• Pages of publication: 3888
• a: 9.4127 ± 0.0003 Å
• b: 21.5662 ± 0.0006 Å
• c: 19.0244 ± 0.0005 Å
• α: 90°
• β: 95.348 ± 0.001°
• γ: 90°
• Cell volume: 3845.07 ± 0.19 ų
• Cell temperature: 103 ± 2 K
• Ambient diffraction temperature: 103 ± 2 K
• Number of distinct elements: 8
• 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: 0.0507
• Residual factor for significantly intense reflections: 0.0333
• Weighted residual factors for significantly intense reflections: 0.0779
• Weighted residual factors for all reflections included in the refinement: 0.0928
• Goodness-of-fit parameter for all reflections included in the refinement: 1.082
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No