Information card for entry 4340591

Structure parameters

• Common name: 7
• Formula: C21 H24 B P
• Calculated formula: C21 H24 B P
• SMILES: [P+](C(C)(C)[BH3])(c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Application of the Donor-Acceptor Concept to Intercept Low Oxidation State Group 14 Element Hydrides using a Wittig Reagent as a Lewis Base.
• Authors of publication: Swarnakar, Anindya K.; McDonald, Sean M.; Deutsch, Kelsey C.; Choi, Paul; Ferguson, Michael J.; McDonald, Robert; Rivard, Eric
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 16
• Pages of publication: 8662 - 8671
• a: 9.7208 ± 0.0004 Å
• b: 9.9807 ± 0.0004 Å
• c: 10.0913 ± 0.0004 Å
• α: 99.4355 ± 0.0004°
• β: 92.3567 ± 0.0005°
• γ: 113.111 ± 0.0004°
• Cell volume: 882.28 ± 0.06 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0388
• Residual factor for significantly intense reflections: 0.0348
• Weighted residual factors for significantly intense reflections: 0.0896
• Weighted residual factors for all reflections included in the refinement: 0.0928
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No