Information card for entry 7707220

Structure parameters

• Formula: C23 H64 Be4 Cl N23 S7
• Calculated formula: C23 H64 Be4 Cl N23 S7
• Title of publication: Ethylenediamine complexes of the beryllium halides and pseudo-halides.
• Authors of publication: Buchner, Magnus R.; Müller, Matthias
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• Journal volume: 50
• Journal issue: 21
• Pages of publication: 7246 - 7255
• a: 13.9529 ± 0.0002 Å
• b: 14.0186 ± 0.0003 Å
• c: 48.6062 ± 0.0007 Å
• α: 90°
• β: 90.185 ± 0.001°
• γ: 90°
• Cell volume: 9507.3 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0775
• Residual factor for significantly intense reflections: 0.0554
• Weighted residual factors for significantly intense reflections: 0.1331
• Weighted residual factors for all reflections included in the refinement: 0.1498
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No