Information card for entry 4002173

Structure parameters

• Formula: C28 H60 B4 Mg2 O26
• Calculated formula: C28 H60 B4 Mg2 O26
• Title of publication: Intercalation of Benzoxaborolate Anions in Layered Double Hydroxides: Toward Hybrid Formulations for Benzoxaborole Drugs
• Authors of publication: Sene, Saad; Bégu, Sylvie; Gervais, Christel; Renaudin, Guillaume; Mesbah, Adel; Smith, Mark E.; Mutin, P. Hubert; van der Lee, Arie; Nedelec, Jean-Marie; Bonhomme, Christian; Laurencin, Danielle
• Journal of publication: Chemistry of Materials
• Year of publication: 2015
• Journal volume: 27
• Journal issue: 4
• Pages of publication: 1242
• a: 11.233986 ± 0.000014 Å
• b: 30.92293 ± 0.00004 Å
• c: 8.6602 ± 0.000013 Å
• α: 90°
• β: 135.414 ± 0.00006°
• γ: 90°
• Cell volume: 2111.87 ± 0.005 ų
• Cell temperature: 290 K
• Ambient diffraction temperature: 290 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
• Residual factor R(I) for significantly intense reflections: 5.6949
• Goodness-of-fit parameter for all reflections: 1.47
• Method of determination: powder diffraction
• Diffraction radiation wavelength: 0.999942 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No