Information card for entry 7114595

Structure parameters

• Formula: C37 H51 N2 Ni
• Calculated formula: C37 H51 N2 Ni
• Title of publication: Selective P4 activation by an organometallic nickel(I) radical: formation of a dinuclear nickel(II) tetraphosphide and related di- and trichalcogenides
• Authors of publication: Stefan Pelties; Dirk Herrmann; Bas de Bruin; Frantisek Hartl; Robert Wolf
• Journal of publication: Chem.Commun.
• Year of publication: 2014
• Journal volume: 50
• Pages of publication: 7014
• a: 9.2397 ± 0.0001 Å
• b: 18.6957 ± 0.0002 Å
• c: 21.5074 ± 0.0002 Å
• α: 90°
• β: 93.779 ± 0.001°
• γ: 90°
• Cell volume: 3707.17 ± 0.07 ų
• Cell temperature: 123.1 ± 0.2 K
• Ambient diffraction temperature: 123.1 ± 0.2 K
• Number of distinct elements: 4
• 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: 0.0427
• Residual factor for significantly intense reflections: 0.0384
• Weighted residual factors for significantly intense reflections: 0.108
• Weighted residual factors for all reflections included in the refinement: 0.1121
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No