Information card for entry 7050141

Structure parameters

• Formula: C24 H26 O3 Sn
• Calculated formula: C24 H26 O3 Sn
• SMILES: [Sn](OC(C(=O)OCC)(C)C)(c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Modeling the catalyst resting state in aryl tin(iv) polymerizations of lactide and estimating the relative rates of transamidation, transesterification and chain transferElectronic supplementary information (ESI) available: kinetic data of reactions C and E in Scheme 2. See http://www.rsc.org/suppdata/nj/b3/b306700a/
• Authors of publication: Chisholm, Malcolm H.; Delbridge, Ewan E.; Gallucci, Judith C.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2004
• Journal volume: 28
• Journal issue: 1
• Pages of publication: 145
• a: 9.433 ± 0.001 Å
• b: 10.255 ± 0.001 Å
• c: 12.18 ± 0.002 Å
• α: 81.66 ± 0.01°
• β: 87.44 ± 0.01°
• γ: 73.95 ± 0.01°
• Cell volume: 1120.3 ± 0.3 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 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: 0.0312
• Residual factor for significantly intense reflections: 0.024
• Weighted residual factors for all reflections: 0.0554
• Weighted residual factors for significantly intense reflections: 0.0527
• Goodness-of-fit parameter for all reflections: 1.081
• Goodness-of-fit parameter for significantly intense reflections: 1.1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No