Information card for entry 7049379

Structure parameters

• Formula: C28 H44 B2 N2 O2
• Calculated formula: C28 H44 B2 N2 O2
• 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: 9.449 ± 0.003 Å
• b: 10.482 ± 0.003 Å
• c: 14.853 ± 0.004 Å
• α: 102.318 ± 0.005°
• β: 95.597 ± 0.004°
• γ: 99.344 ± 0.004°
• Cell volume: 1404.8 ± 0.7 ų
• Cell temperature: 93 ± 2 K
• Ambient diffraction temperature: 93 ± 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: 0.075
• Residual factor for significantly intense reflections: 0.0489
• Weighted residual factors for significantly intense reflections: 0.1088
• Weighted residual factors for all reflections included in the refinement: 0.1216
• Goodness-of-fit parameter for all reflections included in the refinement: 0.943
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No