Information card for entry 7047932

Structure parameters

• Chemical name: Lithium tetrakis(3-carboxyphenyl)borate
• Formula: C37 H37 B Li O10.5
• Calculated formula: C37 H37.002 B Li O10.5
• Title of publication: Synthesis of tetraarylborates via tetralithio intermediates and the effect of polar functional groups and cations on their crystal structures.
• Authors of publication: Tomaszewski, Patryk; Wiszniewski, Marcin; Serwatowski, Janusz; Woźniak, Krzysztof; Durka, Krzysztof; Luliński, Sergiusz
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 46
• Pages of publication: 16627 - 16637
• a: 15.1982 ± 0.0011 Å
• b: 17.4686 ± 0.0005 Å
• c: 17.705 ± 0.002 Å
• α: 90°
• β: 101.258 ± 0.014°
• γ: 90°
• Cell volume: 4610.1 ± 0.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100.01 ± 0.1 K
• Number of distinct elements: 5
• 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: 0.1653
• Residual factor for significantly intense reflections: 0.1392
• Weighted residual factors for significantly intense reflections: 0.39
• Weighted residual factors for all reflections included in the refinement: 0.4246
• Goodness-of-fit parameter for all reflections included in the refinement: 1.754
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No