Information card for entry 1506427

Structure parameters

• Formula: C24 H23 Cl N2 O2 Sn
• Calculated formula: C24 H23 Cl N2 O2 Sn
• SMILES: [Sn]123(Cl)([N](=Cc4c(O2)cccc4)c2c([N]1=Cc1c(O3)cccc1)cccc2)CCCC
• Title of publication: Ring-Opening Polymerization of Trimethylene Carbonate Using Aluminum(III) and Tin(IV) Salen Chloride Catalysts
• Authors of publication: Darensbourg, Donald. J.; Ganguly, Poulomi; Billodeaux, Damon
• Journal of publication: Macromolecules
• Year of publication: 2005
• Journal volume: 38
• Journal issue: 13
• Pages of publication: 5406
• a: 14.276 ± 0.005 Å
• b: 13.93 ± 0.004 Å
• c: 10.985 ± 0.004 Å
• α: 90°
• β: 94.388 ± 0.006°
• γ: 90°
• Cell volume: 2178.1 ± 1.3 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0636
• Residual factor for significantly intense reflections: 0.0418
• Weighted residual factors for significantly intense reflections: 0.0917
• Weighted residual factors for all reflections included in the refinement: 0.119
• Goodness-of-fit parameter for all reflections included in the refinement: 0.956
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No