Information card for entry 4118106

Structure parameters

• Formula: C24.5 H22 Cl F6 N5 Ni O P
• Calculated formula: C24.5 H20 Cl F6 N5 Ni O P
• Title of publication: Formation of N2O from a Nickel Nitrosyl: Isolation of the cis-[N2O2]2- Intermediate
• Authors of publication: Ashley M. Wright; Guang Wu; Trevor W. Hayton
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2012
• Journal volume: 134
• Pages of publication: 9930 - 9933
• a: 13.5487 ± 0.0015 Å
• b: 14.7806 ± 0.0018 Å
• c: 13.6462 ± 0.0016 Å
• α: 90°
• β: 110.055 ± 0.007°
• γ: 90°
• Cell volume: 2567.1 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• 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: 0.1272
• Residual factor for significantly intense reflections: 0.1096
• Weighted residual factors for significantly intense reflections: 0.2506
• Weighted residual factors for all reflections included in the refinement: 0.2565
• Goodness-of-fit parameter for all reflections included in the refinement: 1.225
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No