Information card for entry 7121792

Structure parameters

• Formula: C53 H41 B F20 Mg N2
• Calculated formula: C53 H41 B F20 Mg N2
• Title of publication: Highly Lewis acidic cationic alkaline earth metal complexes.
• Authors of publication: Pahl, Jürgen; Brand, Steffen; Elsen, Holger; Harder, Sjoerd
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2018
• Journal volume: 54
• Journal issue: 63
• Pages of publication: 8685 - 8688
• a: 15.0751 ± 0.0003 Å
• b: 18.2135 ± 0.0004 Å
• c: 19.1996 ± 0.0004 Å
• α: 79.2972 ± 0.0018°
• β: 86.7245 ± 0.0015°
• γ: 72.6916 ± 0.0018°
• Cell volume: 4945.36 ± 0.19 ų
• Cell temperature: 100.01 ± 0.1 K
• Ambient diffraction temperature: 100.01 ± 0.1 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: 0.0522
• Residual factor for significantly intense reflections: 0.0415
• Weighted residual factors for significantly intense reflections: 0.1058
• Weighted residual factors for all reflections included in the refinement: 0.1125
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No