Information card for entry 4115417

Structure parameters

• Common name: Fe2(OCMe2Ph)6
• Formula: C54 H66 Fe2 O6
• Calculated formula: C27 H33 Fe O3
• Title of publication: Rapid and Controlled Polymerization of Lactide by Structurally Characterized Ferric Alkoxides
• Authors of publication: Brendan J. O'Keefe; Susanne M. Monnier; Marc A. Hillmyer; William B. Tolman
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2001
• Journal volume: 123
• Pages of publication: 339 - 340
• a: 12.6689 ± 0.0007 Å
• b: 19.7686 ± 0.0011 Å
• c: 9.9959 ± 0.0005 Å
• α: 90°
• β: 105.434 ± 0.001°
• γ: 90°
• Cell volume: 2413.2 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• 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: 0.0473
• Residual factor for significantly intense reflections: 0.0324
• Weighted residual factors for significantly intense reflections: 0.0729
• Weighted residual factors for all reflections included in the refinement: 0.078
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No