Information card for entry 7701619

Structure parameters

• Formula: C17 H16 B N3
• Calculated formula: C17 H16 B N3
• Title of publication: Expansion of the scope of alkylboryl-bridged N →B-ladder boranes: new substituents and alternative substrates.
• Authors of publication: Pammer, Frank; Schepper, Jonas; Glöckler, Johannes; Sun, Yu; Orthaber, Andreas
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 27
• Pages of publication: 10298 - 10312
• a: 8.4822 ± 0.0003 Å
• b: 14.3531 ± 0.0005 Å
• c: 11.9681 ± 0.0005 Å
• α: 90°
• β: 101.037 ± 0.004°
• γ: 90°
• Cell volume: 1430.12 ± 0.09 ų
• Cell temperature: 150 ± 10 K
• Ambient diffraction temperature: 150 ± 10 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0584
• Residual factor for significantly intense reflections: 0.0468
• Weighted residual factors for significantly intense reflections: 0.113
• Weighted residual factors for all reflections included in the refinement: 0.1195
• Goodness-of-fit parameter for all reflections included in the refinement: 1.094
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No