Information card for entry 4080689

Structure parameters

• Formula: C32 H40 N2 P2 S2 Sn2
• Calculated formula: C32 H40 N2 P2 S2 Sn2
• SMILES: [Sn]12C3(P(=S)(C(C)C)C(C)C)[Sn]([n]4c3ccc3ccccc43)C2(P(=S)(C(C)C)C(C)C)c2[n]1c1c(cc2)cccc1
• Title of publication: Synthesis and Structural Characterization of Lithium, Potassium, Magnesium, and Heavier Group 14 Metal Complexes Derived from 2-Quinolyl-Linked (Thiophosphorano)methane
• Authors of publication: Leung, Wing-Por; Chan, Yuk-Chi; Mak, Thomas C. W.
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 9
• Pages of publication: 2584
• a: 12.7235 ± 0.0012 Å
• b: 24.007 ± 0.002 Å
• c: 22.492 ± 0.002 Å
• α: 90°
• β: 94.649 ± 0.001°
• γ: 90°
• Cell volume: 6847.6 ± 1.1 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0378
• Residual factor for significantly intense reflections: 0.0343
• Weighted residual factors for significantly intense reflections: 0.0868
• Weighted residual factors for all reflections included in the refinement: 0.0887
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No