Information card for entry 7042926

Structure parameters

• Formula: C28.5 H29 Cr2 N4 O11
• Calculated formula: C28.5 H24 Cr2 N4 O11
• Title of publication: Magneto-structural correlations in a family of dialkoxo bridged chromium dimers
• Authors of publication: Brechin, Euan K.; Fraser, Hector; Nichol, Gary Stephen; Velmurugan, Gunasekaran; Rajaraman, Gopalan
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 12.2931 ± 0.0008 Å
• b: 21.3092 ± 0.0016 Å
• c: 13.2192 ± 0.0008 Å
• α: 90°
• β: 106.939 ± 0.007°
• γ: 90°
• Cell volume: 3312.6 ± 0.4 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0979
• Residual factor for significantly intense reflections: 0.083
• Weighted residual factors for significantly intense reflections: 0.2054
• Weighted residual factors for all reflections included in the refinement: 0.2129
• Goodness-of-fit parameter for all reflections included in the refinement: 1.151
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No