Information card for entry 4104661

Structure parameters

• Common name: holkd22
• Formula: C78 H126 Co2 N6 O2
• Calculated formula: C78 H126 Co2 N6 O2
• Title of publication: Cobalt-Dinitrogen Complexes with Weakened N-N Bonds
• Authors of publication: Keying Ding; Aaron W. Pierpont; William W. Brennessel; Gudrun Lukat-Rodgers; Kenton R. Rodgers; Thomas R. Cundari; Eckhard Bill; Patrick L. Holland
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2009
• Journal volume: 131
• Pages of publication: 9471 - 9472
• a: 12.29 ± 0.002 Å
• b: 16.966 ± 0.003 Å
• c: 17.644 ± 0.003 Å
• α: 90°
• β: 93.728 ± 0.004°
• γ: 90°
• Cell volume: 3671.2 ± 1.1 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0623
• Residual factor for significantly intense reflections: 0.0385
• Weighted residual factors for significantly intense reflections: 0.0953
• Weighted residual factors for all reflections included in the refinement: 0.106
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No