Information card for entry 2105678

Structure parameters

• Common name: lithium bromoacetat
• Chemical name: bromoacetic acid, lithium salt
• Formula: C2 H2 Br Li O2
• Calculated formula: C2 Br Li O2
• SMILES: BrCC(=O)[O-].[Li+]
• Title of publication: Structure determination of lithium chloroacetate, lithium bromoacetate and lithium iodoacetate by powder diffraction
• Authors of publication: Ehrenberg, H.; Hasse, B.; Schwarz, K.; Epple, M.
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 4
• Pages of publication: 517 - 524
• a: 9.7165 ± 0.0011 Å
• b: 4.861 ± 0.0006 Å
• c: 9.0228 ± 0.0011 Å
• α: 90°
• β: 93.946 ± 0.005°
• γ: 90°
• Cell volume: 425.15 ± 0.09 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Goodness-of-fit parameter for all reflections: 2.24
• Diffraction radiation wavelength: 1.2841 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No