Information card for entry 4327903

Structure parameters

• Formula: C55 H67 Cr2 N4 O
• Calculated formula: C55 H67 Cr2 N4 O
• Title of publication: Reactivity of Cr(III) μ-Oxo Compounds: Catalyst Regeneration and Atom Transfer Processes
• Authors of publication: K. Cory MacLeod; Brian O. Patrick; Kevin M. Smith
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 688 - 700
• a: 9.1063 ± 0.0008 Å
• b: 14.7309 ± 0.0014 Å
• c: 18.546 ± 0.002 Å
• α: 90.341 ± 0.003°
• β: 95.604 ± 0.004°
• γ: 107.903 ± 0.004°
• Cell volume: 2354.4 ± 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: 0.1274
• Residual factor for significantly intense reflections: 0.0522
• Weighted residual factors for significantly intense reflections: 0.0895
• Weighted residual factors for all reflections included in the refinement: 0.1128
• Goodness-of-fit parameter for all reflections included in the refinement: 0.993
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No