Information card for entry 4312521

Structure parameters

• Formula: C68.5 H69.75 Cl2 Mn2 N10.75 O12.75
• Calculated formula: C68.5 H69.75 Cl2 Mn2 N10.75 O12.75
• Title of publication: First Row Divalent Transition Metal Complexes of Aryl-Appended Tris((pyridyl)methyl)amine Ligands: Syntheses, Structures, Electrochemistry, and Hydroxamate Binding Properties
• Authors of publication: Magdalena M. Makowska-Grzyska; Ewa Szajna; Crystal Shipley; Atta M. Arif; Michael H. Mitchell; Jason A. Halfen; Lisa M. Berreau
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 7472 - 7488
• a: 12.3182 ± 0.0003 Å
• b: 19.6718 ± 0.0003 Å
• c: 28.9826 ± 0.0007 Å
• α: 77.476 ± 0.0014°
• β: 87.0389 ± 0.0012°
• γ: 73.3676 ± 0.0013°
• Cell volume: 6568.7 ± 0.3 ų
• Cell temperature: 150 ± 1 K
• Ambient diffraction temperature: 150 ± 1 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: 0.1685
• Residual factor for significantly intense reflections: 0.0799
• Weighted residual factors for significantly intense reflections: 0.1713
• Weighted residual factors for all reflections included in the refinement: 0.2233
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No