Information card for entry 4065759

Structure parameters

• Formula: C42 H74 N2 O P4 S4 Sn2
• Calculated formula: C42 H74 N2 O P4 S4 Sn2
• SMILES: c1([n]2[Sn]3C4(P(=S)(C(C)C)C(C)C)c5cccc([n]5[Sn]4C3(c2ccc1)P(C(C)C)(=S)C(C)C)CP(=S)(C(C)C)C(C)C)CP(C(C)C)(=S)C(C)C.O1CCCC1
• Title of publication: Synthesis of Heavier Group 14 Metal Compounds from 2,6-Lutidylbis(phosphoranosulfide)
• Authors of publication: Leung, Wing-Por; Kan, Kwok-Wai; Mak, Thomas C. W.
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 8
• Pages of publication: 1890
• a: 21.031 ± 0.002 Å
• b: 15.0474 ± 0.0018 Å
• c: 16.758 ± 0.002 Å
• α: 90°
• β: 91.251 ± 0.002°
• γ: 90°
• Cell volume: 5302 ± 1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0344
• Residual factor for significantly intense reflections: 0.0244
• Weighted residual factors for significantly intense reflections: 0.0618
• Weighted residual factors for all reflections included in the refinement: 0.0689
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No