Information card for entry 4113094

Structure parameters

• Formula: C35 H41 N2 O P Sn
• Calculated formula: C35 H41 N2 O P Sn
• SMILES: [Sn]123Oc4c(cc(cc4C(N1c1c(cccc1)[P]3(c1ccccc1)c1ccccc1)[N]2(C)C)C(C)(C)C)C(C)(C)C
• Title of publication: Unprecedented Reversible Migration of Amide to Schiff Base Ligands Attached to Tin: Latent Single-Site Initiators for Lactide Polymerization
• Authors of publication: Nonsee Nimitsiriwat; Edward L. Marshall; Vernon C. Gibson; Mark R. J. Elsegood; Sophie H. Dale
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2004
• Journal volume: 126
• Pages of publication: 13598 - 13599
• a: 10.1598 ± 0.0003 Å
• b: 11.7014 ± 0.0004 Å
• c: 15.3667 ± 0.0005 Å
• α: 75.595 ± 0.002°
• β: 78.587 ± 0.002°
• γ: 67.167 ± 0.002°
• Cell volume: 1620.22 ± 0.09 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0206
• Residual factor for significantly intense reflections: 0.019
• Weighted residual factors for significantly intense reflections: 0.0484
• Weighted residual factors for all reflections included in the refinement: 0.0493
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No