Information card for entry 7045623

Structure parameters

• Formula: B4 H16 Li Sc
• Calculated formula: B4 H16 Li Sc
• Title of publication: New hydrogen-rich ammonium metal borohydrides, NH₄[M(BH₄)₄], M = Y, Sc, Al, as potential H₂ sources.
• Authors of publication: Starobrat, A.; Jaroń, T; Grochala, W.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 13
• Pages of publication: 4442 - 4448
• a: 14.2842 ± 0.0004 Å
• b: 14.2842 ± 0.0004 Å
• c: 7.3758 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1504.95 ± 0.07 ų
• Cell temperature: 295 K
• Ambient diffraction temperature: 295 K
• Number of distinct elements: 4
• Space group number: 87
• Hermann-Mauguin space group symbol: I 4/m
• Hall space group symbol: -I 4
• Residual factor for all reflections: 0.0484
• Residual factor for significantly intense reflections: 0.0357
• Weighted residual factors for all reflections: 0.0315
• Weighted residual factors for significantly intense reflections: 0.0295
• Goodness-of-fit parameter for all reflections: 0.03
• Method of determination: powder diffraction
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No