Information card for entry 4084265

Structure parameters

• Formula: C27 H37 Cr N6
• Calculated formula: C27 H37 Cr N6
• Title of publication: Chromium-Catalyzed CO2‒Epoxide Copolymerization
• Authors of publication: Gurnham, Joanna; Gambarotta, Sandro; Korobkov, Ilia; Jasinska-Walc, Lidia; Duchateau, Robbert
• Journal of publication: Organometallics
• Year of publication: 2014
• Journal volume: 33
• Journal issue: 17
• Pages of publication: 4401
• a: 15.4907 ± 0.001 Å
• b: 15.9467 ± 0.001 Å
• c: 22.5005 ± 0.0015 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5558.2 ± 0.6 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 4
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.1226
• Residual factor for significantly intense reflections: 0.0702
• Weighted residual factors for significantly intense reflections: 0.1649
• Weighted residual factors for all reflections included in the refinement: 0.1963
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No