Information card for entry 4324816

Structure parameters

• Formula: C54.13 H32.25 Cl0.25 Mn N8
• Calculated formula: C54 H32 Mn N8
• Title of publication: Stabilization of Magnetic Ordering Observed for the Bridging NCN Group
• Authors of publication: Jordan L. Arthur; Curtis E. Moore; Arnold L. Rheingold; Joel S. Miller
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 2735 - 2737
• a: 17.6731 ± 0.0015 Å
• b: 22.61 ± 0.002 Å
• c: 11.5115 ± 0.0009 Å
• α: 90°
• β: 107.23 ± 0.006°
• γ: 90°
• Cell volume: 4393.4 ± 0.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0742
• Residual factor for significantly intense reflections: 0.0563
• Weighted residual factors for significantly intense reflections: 0.1382
• Weighted residual factors for all reflections included in the refinement: 0.1474
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No