Information card for entry 7121667

Structure parameters

• Formula: C40 H39 B F20 Mg N4
• Calculated formula: C40 H39 B F20 Mg N4
• Title of publication: A disguised hydride in a butylmagnesium cation.
• Authors of publication: Banerjee, Sumanta; Ankur, ?; Andrews, Alex; Venugopal, Ajay
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2018
• Journal volume: 54
• Journal issue: 45
• Pages of publication: 5788 - 5791
• a: 12.305 ± 0.003 Å
• b: 12.709 ± 0.003 Å
• c: 15.464 ± 0.003 Å
• α: 69.721 ± 0.008°
• β: 70.14 ± 0.008°
• γ: 83.743 ± 0.008°
• Cell volume: 2133.4 ± 0.8 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0515
• Residual factor for significantly intense reflections: 0.0354
• Weighted residual factors for significantly intense reflections: 0.0848
• Weighted residual factors for all reflections included in the refinement: 0.095
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No