Information card for entry 7130516

Structure parameters

• Formula: C30 H51 B
• Calculated formula: C30 H51 B
• Title of publication: Terpene Dispersion Energy Donor Ligands in Borane Complexes
• Authors of publication: Mears, Kristian; Kutzleb, Michelle; Stennett, Cary; Fettinger, James C.; Kaseman, Derrick; Yu, Ping; Vasko, Petra; Power, Philip P.
• Journal of publication: Chemical Communications
• Year of publication: 2022
• a: 16.905 ± 0.005 Å
• b: 16.905 ± 0.005 Å
• c: 8.039 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 1989.6 ± 1.1 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 3
• Space group number: 146
• Hermann-Mauguin space group symbol: R 3 :H
• Hall space group symbol: R 3
• Residual factor for all reflections: 0.0373
• Residual factor for significantly intense reflections: 0.0364
• Weighted residual factors for significantly intense reflections: 0.0918
• Weighted residual factors for all reflections included in the refinement: 0.0927
• Goodness-of-fit parameter for all reflections included in the refinement: 1.076
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No