Information card for entry 7031925

Structure parameters

• Formula: C36 H36 N6 Sn2
• Calculated formula: C36 H36 N6 Sn2
• SMILES: n1c(cccc1C)[Sn](c1cccc(n1)C)(c1nc(ccc1)C)[Sn](c1nc(ccc1)C)(c1nc(ccc1)C)c1nc(ccc1)C
• 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: 9.1614 ± 0.0013 Å
• b: 9.8389 ± 0.0012 Å
• c: 19.42 ± 0.003 Å
• α: 90°
• β: 103.551 ± 0.004°
• γ: 90°
• Cell volume: 1701.8 ± 0.4 ų
• Cell temperature: 199 ± 2 K
• Ambient diffraction temperature: 199 ± 2 K
• Number of distinct elements: 4
• 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: 0.0471
• Residual factor for significantly intense reflections: 0.0352
• Weighted residual factors for significantly intense reflections: 0.1052
• Weighted residual factors for all reflections included in the refinement: 0.1139
• Goodness-of-fit parameter for all reflections included in the refinement: 1.095
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No