Information card for entry 7128851

Structure parameters

• Formula: C36 H47 F6 N9 Ni O5 S2
• Calculated formula: C36 H47 F6 N9 Ni O4 S2
• Title of publication: Hydrosilylative reduction of primary amides to primary amines catalyzed by a terminal [Ni-OH] complex.
• Authors of publication: Pandey, Pragati; Bera, Jitendra K.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2021
• Journal volume: 57
• Journal issue: 73
• Pages of publication: 9204 - 9207
• a: 23.6705 ± 0.0011 Å
• b: 23.6705 ± 0.0011 Å
• c: 16.1646 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 7843.5 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 170
• Hermann-Mauguin space group symbol: P 65
• Hall space group symbol: P 65
• Residual factor for all reflections: 0.0652
• Residual factor for significantly intense reflections: 0.0449
• Weighted residual factors for significantly intense reflections: 0.1031
• Weighted residual factors for all reflections included in the refinement: 0.1117
• 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: Yes
• Has Fobs: No