Information card for entry 7035321

Structure parameters

• Formula: C62 H73 Mn
• Calculated formula: C62 H73 Mn
• Title of publication: Synthesis and characterization of manganese triple-decker complexes.
• Authors of publication: Heinl, Sebastian; Balázs, Gábor; Bodensteiner, Michael; Scheer, Manfred
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 5
• Pages of publication: 1962 - 1966
• a: 14.1067 ± 0.0007 Å
• b: 14.571 ± 0.0005 Å
• c: 14.6081 ± 0.0005 Å
• α: 105.957 ± 0.003°
• β: 94.745 ± 0.003°
• γ: 118.726 ± 0.004°
• Cell volume: 2448.1 ± 0.2 ų
• Cell temperature: 123.01 ± 0.1 K
• Ambient diffraction temperature: 123.01 ± 0.1 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0484
• Residual factor for significantly intense reflections: 0.042
• Weighted residual factors for significantly intense reflections: 0.111
• Weighted residual factors for all reflections included in the refinement: 0.1163
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No