Information card for entry 2013265

Structure parameters

• Chemical name: [μ-(E)-4,4'-(1,2-ethenediyl)dipyridine-κ^2^-N:N']bis[bromotris(4- methylphenyl)tin(IV)]
• Formula: C54 H52 Br2 N2 Sn2
• Calculated formula: C54 H52 Br2 N2 Sn2
• SMILES: [n]1(ccc(cc1)/C=C/c1cc[n](cc1)[Sn](Br)(c1ccc(cc1)C)(c1ccc(cc1)C)c1ccc(cc1)C)[Sn](c1ccc(cc1)C)(c1ccc(cc1)C)(c1ccc(cc1)C)Br
• Title of publication: Isostructural or not? Adducts of some aryltin halides with (<i>E</i>)-1,2-bis(4-pyridyl)ethene
• Authors of publication: Bajue, Stanley A.; Lewis, Choy; Clarke, Karen; Bramwell, Fitzgerald B.; Patrick, Brian O.; Brock, Carolyn Pratt
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 6
• Pages of publication: m207 - m211
• a: 11.736 ± 0.001 Å
• b: 12.06 ± 0.001 Å
• c: 18.054 ± 0.002 Å
• α: 90°
• β: 98.76 ± 0.01°
• γ: 90°
• Cell volume: 2525.5 ± 0.4 ų
• Cell temperature: 295 ± 1 K
• Ambient diffraction temperature: 295 ± 1 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: 0.042
• Residual factor for significantly intense reflections: 0.036
• Weighted residual factors for significantly intense reflections: 0.101
• Weighted residual factors for all reflections included in the refinement: 0.105
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes