Information card for entry 7009540

Structure parameters

• Formula: C53 H46 Cl5 Mn2 N O P4
• Calculated formula: C53 H46 Cl5 Mn2 N O P4
• Title of publication: Coordination chemistry of a bulky redox-active cyanomanganese carbonyl ligand: N-bound tetrahedral complexes of 3d metals
• Authors of publication: Connelly, Neil G.; Hicks, Owen M.; Lewis, Gareth R.; Orpen, A. Guy; Wood, Andrew J.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 10
• Pages of publication: 1637
• a: 12.629 ± 0.003 Å
• b: 23.525 ± 0.004 Å
• c: 18.306 ± 0.004 Å
• α: 90°
• β: 104.31 ± 0.02°
• γ: 90°
• Cell volume: 5270 ± 2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• 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: 0.0932
• Residual factor for significantly intense reflections: 0.0521
• Weighted residual factors for all reflections: 0.1416
• Weighted residual factors for significantly intense reflections: 0.1193
• Goodness-of-fit parameter for all reflections: 1.017
• Goodness-of-fit parameter for significantly intense reflections: 1.088
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No