Information card for entry 4306384

Structure parameters

• Formula: C110 H136 K2 Mn2 N8 O4
• Calculated formula: C110 H136 K2 Mn2 N8 O4
• Title of publication: Metalloradical Complexes of Manganese and Chromium Featuring an Oxidatively Rearranged Ligand
• Authors of publication: Remle Çelenligil-Çetin; Patrina Paraskevopoulou; Nikolia Lalioti; Yiannis Sanakis; Richard J. Staples; Nigam P. Rath; Pericles Stavropoulos
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 10998 - 11009
• a: 12.6764 ± 0.0017 Å
• b: 13.4406 ± 0.0018 Å
• c: 16.108 ± 0.002 Å
• α: 79.94 ± 0.003°
• β: 67.018 ± 0.003°
• γ: 83.947 ± 0.003°
• Cell volume: 2485.7 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 99 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0778
• Residual factor for significantly intense reflections: 0.0562
• Weighted residual factors for significantly intense reflections: 0.133
• Weighted residual factors for all reflections included in the refinement: 0.1441
• Goodness-of-fit parameter for all reflections included in the refinement: 1.152
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No