Information card for entry 4101641

Structure parameters

• Formula: C27 H63 Co N5 P3 Zr
• Calculated formula: C27 H63 Co N5 P3 Zr
• Title of publication: Metal-metal multiple bonds in early/late heterobimetallics support unusual trigonal monopyramidal geometries at both Zr and Co.
• Authors of publication: Greenwood, Bennett P.; Rowe, Gerard T.; Chen, Chun-Hsing; Foxman, Bruce M.; Thomas, Christine M.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2010
• Journal volume: 132
• Journal issue: 1
• Pages of publication: 44 - 45
• a: 18.2757 ± 0.0006 Å
• b: 18.2757 ± 0.0006 Å
• c: 18.1771 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 5257.8 ± 0.3 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 K
• Number of distinct elements: 6
• Space group number: 158
• Hermann-Mauguin space group symbol: P 3 c 1
• Hall space group symbol: P 3 -2"c
• Residual factor for all reflections: 0.0771
• Residual factor for significantly intense reflections: 0.0402
• Weighted residual factors for all reflections: 0.0915
• Weighted residual factors for significantly intense reflections: 0.0829
• Weighted residual factors for all reflections included in the refinement: 0.0915
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No