Information card for entry 4311211

Structure parameters

• Formula: C43 H51 Br2 N2 O2 Sn
• Calculated formula: C42.9985 H51 Br2 N2 O2 Sn
• Title of publication: (Salen)Tin Complexes: Syntheses, Characterization, Crystal Structures, and Catalytic Activity in the Formation of Propylene Carbonate from CO2 and Propylene Oxide
• Authors of publication: Huanwang Jing; Smita K. Edulji; Julianne M. Gibbs; Charlotte L. Stern; Hongying Zhou; Sonbinh T. Nguyen
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 4315 - 4327
• a: 12.444 ± 0.002 Å
• b: 26.662 ± 0.004 Å
• c: 12.924 ± 0.002 Å
• α: 90°
• β: 94.354 ± 0.003°
• γ: 90°
• Cell volume: 4275.6 ± 1.1 ų
• Cell temperature: 153.2 K
• Ambient diffraction temperature: 153.2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.1343
• Residual factor for significantly intense reflections: 0.039
• Weighted residual factors for all reflections: 0.097
• Weighted residual factors for all reflections included in the refinement: 0.035
• Goodness-of-fit parameter for all reflections: 1.258
• Goodness-of-fit parameter for all reflections included in the refinement: 1.24
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No