Information card for entry 4073116

Structure parameters

• Formula: C40 H54 O2 Sn2
• Calculated formula: C40 H54 O2 Sn2
• SMILES: c1(cc(c(cc1OCCCCCCCC)[Sn](C#CC)(C#CC)C#CC)OCCCCCCCC)[Sn](C#CC)(C#CC)C#CC
• Title of publication: α,ω-Bis(trialkynyltin) Compounds with a Linear or Cross-Shaped Spacer
• Authors of publication: Elhamzaoui, Hicham; Jousseaume, Bernard; Toupance, Thierry; Allouchi, Hassan
• Journal of publication: Organometallics
• Year of publication: 2007
• Journal volume: 26
• Journal issue: 16
• Pages of publication: 3908
• a: 8.1292 ± 0.0005 Å
• b: 11.3297 ± 0.0006 Å
• c: 11.9733 ± 0.0007 Å
• α: 114.029 ± 0.006°
• β: 92.593 ± 0.005°
• γ: 96.61 ± 0.005°
• Cell volume: 995.33 ± 0.11 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0449
• Residual factor for significantly intense reflections: 0.0327
• Weighted residual factors for significantly intense reflections: 0.0646
• Weighted residual factors for all reflections included in the refinement: 0.0672
• Goodness-of-fit parameter for all reflections included in the refinement: 0.95
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No