Information card for entry 7021498

Structure parameters

• Formula: C24 H49 B N P
• Calculated formula: C24 H49 B N P
• SMILES: P(=NB(C1CCCCC1)C1CCCCC1)(C(C)(C)C)(C(C)(C)C)C(C)(C)C
• Title of publication: Boron azides in Staudinger oxidations and cycloadditions.
• Authors of publication: Melen, Rebecca L.; Lough, Alan J.; Stephan, Douglas W.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 24
• Pages of publication: 8674 - 8683
• a: 8.5008 ± 0.0004 Å
• b: 10.7942 ± 0.0005 Å
• c: 14.9113 ± 0.0006 Å
• α: 97.788 ± 0.002°
• β: 100.943 ± 0.002°
• γ: 106.893 ± 0.002°
• Cell volume: 1258.65 ± 0.1 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0504
• Residual factor for significantly intense reflections: 0.0387
• Weighted residual factors for significantly intense reflections: 0.0956
• Weighted residual factors for all reflections included in the refinement: 0.1025
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No