Information card for entry 4103460

Structure parameters

• Common name: NiTetI2
• Formula: C24 H32 I2 N8 Ni
• Calculated formula: C24 I2 N8 Ni
• Title of publication: Reductions of Challenging Organic Substrates by a Nickel Complex of a Noninnocent Crown Carbene Ligand
• Authors of publication: Neil J. Findlay; Stuart R. Park; Franziska Schoenebeck; Elise Cahard; Sheng-ze Zhou; Leonard E. A. Berlouis; Mark D. Spicer; Tell Tuttle; John A. Murphy
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2010
• Journal volume: 132
• Pages of publication: 15462 - 15464
• a: 8.9439 ± 0.0003 Å
• b: 8.9439 ± 0.0003 Å
• c: 18.6755 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1493.92 ± 0.09 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 5
• Space group number: 139
• Hermann-Mauguin space group symbol: I 4/m m m
• Hall space group symbol: -I 4 2
• Residual factor for all reflections: 0.0315
• Residual factor for significantly intense reflections: 0.029
• Weighted residual factors for significantly intense reflections: 0.081
• Weighted residual factors for all reflections included in the refinement: 0.0824
• Goodness-of-fit parameter for all reflections included in the refinement: 1.166
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No