Information card for entry 4319474

Structure parameters

• Formula: C15 H11 Mn N12
• Calculated formula: C15 H11 Mn N12
• Title of publication: High-Frequency EPR Study of a New Mononuclear Manganese(III) Complex: [(terpy)Mn(N3)3] (terpy = 2,2':6',2''-Terpyridine)
• Authors of publication: Julian Limburg; John S. Vrettos; Robert H. Crabtree; Gary W. Brudvig; Julio C. de Paula; Alia Hassan; Anne-Laure Barra; Carole Duboc-Toia; Marie-Noëlle Collomb
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 1698 - 1703
• a: 8.481 ± 0.001 Å
• b: 8.907 ± 0.002 Å
• c: 12.109 ± 0.002 Å
• α: 93.79 ± 0.01°
• β: 103.17 ± 0.01°
• γ: 103.11 ± 0.01°
• Cell volume: 860.7 ± 0.3 ų
• Cell temperature: 183.2 K
• Ambient diffraction temperature: 183.2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.0369
• Weighted residual factors for significantly intense reflections: 0.0468
• Goodness-of-fit parameter for significantly intense reflections: 2.079
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKalpha
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No