Information card for entry 7025701

Structure parameters

• Formula: C34 H46 N2 O2 Sn
• Calculated formula: C34 H46 N2 O2 Sn
• SMILES: [Sn]1(C#CC(=O)OCC)[N](=C(C=C(C)N1c1c(cccc1C(C)C)C(C)C)C)c1c(C(C)C)cccc1C(C)C
• Title of publication: Reaction of β-diketiminate tin(II) dimethylamide LSnNMe₂ [L = HC(CMeNAr)₂; Ar = 2,6-iPr₂C₆H₃] with ketones and alkynes.
• Authors of publication: Jana, Anukul; Objartel, Ina; Roesky, Herbert W.; Stalke, Dietmar
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 19
• Pages of publication: 4647 - 4650
• a: 12.777 ± 0.002 Å
• b: 19.911 ± 0.004 Å
• c: 13.186 ± 0.002 Å
• α: 90°
• β: 104.998 ± 0.002°
• γ: 90°
• Cell volume: 3240.3 ± 1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.0307
• Residual factor for significantly intense reflections: 0.0249
• Weighted residual factors for significantly intense reflections: 0.0564
• Weighted residual factors for all reflections included in the refinement: 0.0592
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No