Information card for entry 7027995

Structure parameters

• Formula: C56 H48 Br2 Mn N O2 P4 Zn
• Calculated formula: C56 H48 Br2 Mn N O2 P4 Zn
• Title of publication: Zinc, cadmium and mercury complexes of redox-active cyanomanganese carbonyl ligands: intramolecular electron transfer through tetrahedral d10 metal centres
• Authors of publication: Connelly, Neil G.; Lewis, Gareth R.; Moreno, M. Teresa; Orpen, A. Guy
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1998
• Journal issue: 11
• Pages of publication: 1905
• a: 13.332 ± 0.005 Å
• b: 14.664 ± 0.004 Å
• c: 14.992 ± 0.003 Å
• α: 79.12 ± 0.02°
• β: 83.13 ± 0.03°
• γ: 64.25 ± 0.02°
• Cell volume: 2590.1 ± 1.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0873
• Residual factor for significantly intense reflections: 0.059
• Weighted residual factors for all reflections: 0.1364
• Weighted residual factors for significantly intense reflections: 0.1121
• Goodness-of-fit parameter for all reflections: 1.218
• Goodness-of-fit parameter for significantly intense reflections: 1.149
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No