Information card for entry 2217778

Structure parameters

• Chemical name: Dichloridobis(methylamine-κN)boron(III) chloride
• Formula: C2 H10 B Cl3 N2
• Calculated formula: C2 H10 B Cl3 N2
• SMILES: [Cl-].Cl[B](Cl)([NH2]C)[NH2]C
• Title of publication: Dichloridobis(methylamine-κ<i>N</i>)boron(III) chloride
• Authors of publication: Weinmann, Markus; Nuss, Jürgen; Jansen, Martin
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 3
• Pages of publication: o583
• a: 9.9881 ± 0.0011 Å
• b: 11.8071 ± 0.0013 Å
• c: 14.1039 ± 0.0015 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1663.3 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.052
• Residual factor for significantly intense reflections: 0.0431
• Weighted residual factors for significantly intense reflections: 0.0864
• Weighted residual factors for all reflections included in the refinement: 0.0891
• Goodness-of-fit parameter for all reflections included in the refinement: 1.218
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes