Information card for entry 2206541

Structure parameters

• Common name: (diisopropylamino)(1-indenyl)(isopropylamino)borane
• Chemical name: (diisopropylamino)(1-indenyl)(isopropylamino)borane
• Formula: C18 H29 B N2
• Calculated formula: C18 H29 B N2
• SMILES: N(C(C)C)B(N(C(C)C)C(C)C)C1c2c(C=C1)cccc2
• Title of publication: <i>rac</i>-(Diisopropylamino)(1-indenyl)(isopropylamino)borane
• Authors of publication: Braunschweig, Holger; Breitling, Frank Michael; Seeler, Fabian
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 8
• Pages of publication: o2343 - o2344
• a: 8.1029 ± 0.0008 Å
• b: 14.0352 ± 0.0014 Å
• c: 15.6679 ± 0.0015 Å
• α: 90°
• β: 100.503 ± 0.002°
• γ: 90°
• Cell volume: 1752 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• 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: 0.0592
• Residual factor for significantly intense reflections: 0.0452
• Weighted residual factors for significantly intense reflections: 0.1059
• Weighted residual factors for all reflections included in the refinement: 0.1138
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes