Information card for entry 7232641

Structure parameters

• Formula: C68 H65 B2 N7 Ni
• Calculated formula: C68 H65 B2 N7 Ni
• Title of publication: Solvent-Free Synthesis and Reactivity of Nickel(II) Borohydride and Nickel(II) Hydride
• Authors of publication: Angamuthu, Raja; Raje, Sakthi
• Journal of publication: Green Chemistry
• Year of publication: 2019
• a: 11.5825 ± 0.0005 Å
• b: 13.5215 ± 0.0006 Å
• c: 19.6576 ± 0.0008 Å
• α: 98.75 ± 0.001°
• β: 101.464 ± 0.001°
• γ: 103.617 ± 0.001°
• Cell volume: 2867.7 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0588
• Residual factor for significantly intense reflections: 0.0419
• Weighted residual factors for significantly intense reflections: 0.1188
• Weighted residual factors for all reflections included in the refinement: 0.1326
• Goodness-of-fit parameter for all reflections included in the refinement: 0.964
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No