Information card for entry 4303516

Structure parameters

• Chemical name: Ti(L_OMe)(NMe2)2 . 2(C6H6)
• Formula: C37 H53 N5 O5 S2 Ti
• Calculated formula: C37 H53 N5 O5 S2 Ti
• Title of publication: Sulfonamide-Supported Group 4 Catalysts for the Ring-Opening Polymerization of ε-Caprolactone and rac-Lactide
• Authors of publication: Andrew D. Schwarz; Amber L. Thompson; Philip Mountford
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 10442 - 10454
• a: 13.961 ± 0.0005 Å
• b: 12.7787 ± 0.0005 Å
• c: 21.6251 ± 0.001 Å
• α: 90°
• β: 93.0481 ± 0.0012°
• γ: 90°
• Cell volume: 3852.5 ± 0.3 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1498
• Residual factor for significantly intense reflections: 0.0672
• Weighted residual factors for all reflections: 0.1056
• Weighted residual factors for significantly intense reflections: 0.067
• Weighted residual factors for all reflections included in the refinement: 0.067
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1702
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No