Information card for entry 4303262

Structure parameters

• Formula: C45 H72 N4 O14.25 Zn3
• Calculated formula: C36 H54 N4 O12 Zn3
• Title of publication: Di- and Tri-Zinc Catalysts for the Low-Pressure Copolymerization of CO2 and Cyclohexene Oxide
• Authors of publication: Michael R. Kember; Andrew J. P. White; Charlotte K. Williams
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 9535 - 9542
• a: 20.2849 ± 0.0005 Å
• b: 20.4982 ± 0.0004 Å
• c: 23.684 ± 0.0006 Å
• α: 73.361 ± 0.002°
• β: 89.007 ± 0.002°
• γ: 61.549 ± 0.002°
• Cell volume: 8212.7 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0727
• Residual factor for significantly intense reflections: 0.0457
• Weighted residual factors for significantly intense reflections: 0.1197
• Weighted residual factors for all reflections included in the refinement: 0.1294
• Goodness-of-fit parameter for all reflections included in the refinement: 0.935
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No