Information card for entry 4081408

Structure parameters

• Formula: C30 H34 N2 S3 Sn
• Calculated formula: C30 H34 N2 S3 Sn
• SMILES: [Sn](Sc1ccccc1)(Sc1ccccc1)(Sc1ccccc1)c1c(CN(C)C)cccc1CN(C)C
• Title of publication: Reactivity of Organotin(I) Dimers RSnSnR (R = 2,6-(Me2NCH2)2C6H3, 4-t-Bu-2,6-{P(O)(O-i-Pr)2}2C6H2) with Diaryl Dichalcogenides, ArEEAr (E = S, Se, Te; Ar = Ph, 2-C5H4N): Control of Secondary Sn···Sn Interactions by Intramolecular Coordination and Identity of the Aryl Chalcogenate
• Authors of publication: Wagner, Michael; Dietz, Christina; Bouška, Marek; Dostál, Libor; Padĕlková, Zdeňka; Jambor, Roman; Jurkschat, Klaus
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 17
• Pages of publication: 4973
• a: 9.924 ± 0.0007 Å
• b: 10.634 ± 0.0013 Å
• c: 28.755 ± 0.003 Å
• α: 99.536 ± 0.008°
• β: 98.171 ± 0.006°
• γ: 97.784 ± 0.008°
• Cell volume: 2922.7 ± 0.5 ų
• Cell temperature: 150 ± 1 K
• Ambient diffraction temperature: 150 ± 1 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.076
• Residual factor for significantly intense reflections: 0.049
• Weighted residual factors for significantly intense reflections: 0.0801
• Weighted residual factors for all reflections included in the refinement: 0.089
• Goodness-of-fit parameter for all reflections included in the refinement: 1.113
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No