Information card for entry 7031926

Structure parameters

• Formula: C27 H24 Al Cl2 N5 O0.5 Sn2
• Calculated formula: C27 H24 Al Cl2 N5 O0.5 Sn2
• SMILES: [Sn]12c3[n]([Al]45([Cl][Sn](Cl)(c6[n]4cccc6)c4[n]5cccc4)([n]4c1cccc4)[n]1ccccc21)cccc3.C1CCCO1
• Title of publication: Direct synthesis of the Janus-head ligand ((Me)Py)3Sn-Sn((Me)Py)3 using an unusual pyridyl-transfer reaction ((Me)Py = 6-methyl-2-pyridyl).
• Authors of publication: García-Rodríguez, Raúl; Wright, Dominic S.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 39
• Pages of publication: 14529 - 14532
• a: 16.4409 ± 0.0018 Å
• b: 19.855 ± 0.002 Å
• c: 17.9265 ± 0.0018 Å
• α: 90°
• β: 90.455 ± 0.003°
• γ: 90°
• Cell volume: 5851.6 ± 1.1 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 7
• 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: 0.1186
• Residual factor for significantly intense reflections: 0.0752
• Weighted residual factors for significantly intense reflections: 0.1845
• Weighted residual factors for all reflections included in the refinement: 0.214
• Goodness-of-fit parameter for all reflections included in the refinement: 1.116
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No