Information card for entry 7029033

Structure parameters

• Formula: C56 H74.5 Br4 Co2 N10 O5.25
• Calculated formula: C56 H74 Br4 Co2 N10 O5.25
• Title of publication: New cobalt, iron and chromium catalysts based on easy-to-handle N4-chelating ligands for the coupling reaction of epoxides with CO2.
• Authors of publication: Adolph, M.; Zevaco, T. A.; Altesleben, C.; Walter, O.; Dinjus, E.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 8
• Pages of publication: 3285 - 3296
• a: 17.824 ± 0.0015 Å
• b: 16.6669 ± 0.0014 Å
• c: 20.3735 ± 0.0017 Å
• α: 90°
• β: 101.502 ± 0.001°
• γ: 90°
• Cell volume: 5930.8 ± 0.9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0798
• Residual factor for significantly intense reflections: 0.039
• Weighted residual factors for significantly intense reflections: 0.062
• Weighted residual factors for all reflections included in the refinement: 0.0706
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No