Information card for entry 7049381

Structure parameters

• Formula: C26 H38 B2 Br2 N2
• Calculated formula: C26 H38 B2 Br2 N2
• Title of publication: Synthesis of a hydrogen-bridged tetraborane(6): a substituent effect of a diaminoboryl group toward the B-B multiple bond character.
• Authors of publication: Yagi, Atsumi; Kisu, Haruki; Yamashita, Makoto
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 17
• Pages of publication: 5496 - 5499
• a: 9.5962 ± 0.0019 Å
• b: 16.165 ± 0.003 Å
• c: 18.035 ± 0.004 Å
• α: 90°
• β: 92.959 ± 0.003°
• γ: 90°
• Cell volume: 2793.9 ± 1 ų
• Cell temperature: 93 ± 2 K
• Ambient diffraction temperature: 93 ± 2 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: 0.0941
• Residual factor for significantly intense reflections: 0.0544
• Weighted residual factors for significantly intense reflections: 0.1059
• Weighted residual factors for all reflections included in the refinement: 0.1227
• Goodness-of-fit parameter for all reflections included in the refinement: 0.964
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No