Information card for entry 2225577

Structure parameters

• Chemical name: Bis(ethylenediammonium) tetradecaborate
• Formula: C4 H26 B14 N4 O26
• Calculated formula: C4 H26 B14 N4 O26
• SMILES: B1(O)O[B@@]23OB(O1)OB1O[B@@]4(O[B@@]5(OB(O)OB(OB6O[B@@](O2)(OB(O3)O)OB(O6)O)O5)OB(O)O4)OB(O1)O.C(C[NH3+])[NH3+].C(C[NH3+])[NH3+]
• Title of publication: Bis(ethylenediammonium) tetradecaborate
• Authors of publication: Wang, Guo-Ming; Wang, Pei; Li, Zeng-Xin; Li, Hui; Liu, Hui-Luan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 4
• Pages of publication: o798 - o799
• a: 8.4849 ± 0.0003 Å
• b: 8.8387 ± 0.0003 Å
• c: 10.0406 ± 0.0002 Å
• α: 95.085 ± 0.002°
• β: 96.942 ± 0.003°
• γ: 116.856 ± 0.004°
• Cell volume: 658.08 ± 0.04 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0561
• Residual factor for significantly intense reflections: 0.0431
• Weighted residual factors for significantly intense reflections: 0.1007
• Weighted residual factors for all reflections included in the refinement: 0.1074
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes