Information card for entry 7700035

Structure parameters

• Formula: C44 H60 Mn4 N16 O8
• Calculated formula: C44 H60 Mn4 N16 O8
• Title of publication: The catalytic activities and magnetic behaviours of a μ3-chlorido and a μ1,1,1-azido bridged rare defective dicubane tetranuclear Mn(II) complexes
• Authors of publication: Das, Avijit; Chakraborty, Maharudra; Maity, Souvik; Ghosh, Ashutosh
• Journal of publication: Dalton Transactions
• Year of publication: 2019
• a: 32.5215 ± 0.0012 Å
• b: 32.5215 ± 0.0012 Å
• c: 14.0934 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 12908.8 ± 0.9 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 5
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.0605
• Residual factor for significantly intense reflections: 0.0466
• Weighted residual factors for significantly intense reflections: 0.1145
• Weighted residual factors for all reflections included in the refinement: 0.1282
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No