Information card for entry 7712661

Structure parameters

• Formula: C6 H18 Be Br2 P2
• Calculated formula: C6 H18 Be Br2 P2
• Title of publication: Ligand exchange at tetra-coordinated beryllium centres
• Authors of publication: Buchner, Magnus Richard; Cocic, Dusan; Ivlev, Sergei; Spang, Nils; Müller, Matthias; Puchta, Ralph
• Journal of publication: Dalton Transactions
• Year of publication: 2023
• a: 6.4872 ± 0.0013 Å
• b: 14.511 ± 0.003 Å
• c: 21.904 ± 0.004 Å
• α: 90°
• β: 93.41 ± 0.03°
• γ: 90°
• Cell volume: 2058.3 ± 0.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.0483
• Residual factor for significantly intense reflections: 0.0336
• Weighted residual factors for significantly intense reflections: 0.0894
• Weighted residual factors for all reflections included in the refinement: 0.0949
• Goodness-of-fit parameter for all reflections included in the refinement: 0.986
• Diffraction radiation wavelength: 1.54186 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No