Information card for entry 7106242

Structure parameters

• Formula: As2 Be3 H4 O10
• Calculated formula: As2 Be3 H4 O10
• SMILES: O=[As]([O-])([O-])[O-].[Be+2].O=[As]([O-])([O-])[O-].[Be+2].[Be+2].O.O
• Title of publication: Berylloarsenates ‒ new frameworks, building units and an unusual zeotype
• Authors of publication: Littlefield, Benjamin T. R.; Welle, Mark T.
• Journal of publication: Chemical Communications (Cambridge, United Kingdom)
• Year of publication: 2011
• Journal volume: 47
• Pages of publication: 4769 - 4771
• a: 16.2789 ± 0.0006 Å
• b: 4.653 ± 0.0002 Å
• c: 9.8544 ± 0.0004 Å
• α: 90°
• β: 93.679 ± 0.002°
• γ: 90°
• Cell volume: 744.89 ± 0.05 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0184
• Residual factor for significantly intense reflections: 0.0172
• Weighted residual factors for significantly intense reflections: 0.0441
• Weighted residual factors for all reflections included in the refinement: 0.045
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No