Information card for entry 4120925

Structure parameters

• Formula: C12 H29 F6 N4 Ni P Se
• Calculated formula: C12 H29 F6 N4 Ni P Se
• Title of publication: C-H Activation by a Diselenido Dinickel(II) Complex
• Authors of publication: Jessica Wallick; Charles G. Riordan; Glenn P. A. Yap
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2013
• Journal volume: 135
• Pages of publication: 14972 - 14974
• a: 13.701 ± 0.003 Å
• b: 9.683 ± 0.002 Å
• c: 14.533 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1928 ± 0.7 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 7
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0419
• Residual factor for significantly intense reflections: 0.0315
• Weighted residual factors for significantly intense reflections: 0.0691
• Weighted residual factors for all reflections included in the refinement: 0.0741
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No