Information card for entry 4073111

Structure parameters

• Formula: C44 H86 O2 Sn2
• Calculated formula: C44 H86 O2 Sn2
• SMILES: O(c1c(cc(OCCCCCCCCCCCCCCCC)c(c1)[Sn](C)(C)C)[Sn](C)(C)C)CCCCCCCCCCCCCCCC
• 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: 7.428 ± 0.0003 Å
• b: 9.861 ± 0.0004 Å
• c: 16.705 ± 0.0004 Å
• α: 83.79 ± 0.002°
• β: 89.035 ± 0.003°
• γ: 72.043 ± 0.002°
• Cell volume: 1156.99 ± 0.07 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: 0.0286
• Residual factor for significantly intense reflections: 0.023
• Weighted residual factors for significantly intense reflections: 0.0535
• Weighted residual factors for all reflections included in the refinement: 0.0559
• Goodness-of-fit parameter for all reflections included in the refinement: 1.098
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No