Information card for entry 7232642

Structure parameters

• Chemical name: Olex2 1.2(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
• Formula: C38 H40 B2 N4 Ni
• Calculated formula: C38 H40 B2 N4 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: 11.1094 ± 0.0007 Å
• b: 15.0969 ± 0.0009 Å
• c: 18.9302 ± 0.0012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3174.9 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0762
• Residual factor for significantly intense reflections: 0.0508
• Weighted residual factors for significantly intense reflections: 0.0918
• Weighted residual factors for all reflections included in the refinement: 0.1005
• 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