Information card for entry 7231654

Structure parameters

• Formula: C37 H39 B N2
• Calculated formula: C37 H39 B N2
• Title of publication: Anion influences on reactivity and NMR spectroscopic features of NHC precursors
• Authors of publication: Huynh, Han Vinh; Lam, Truc Tien; Luong, Huyen T. T.
• Journal of publication: RSC Advances
• Year of publication: 2018
• Journal volume: 8
• Journal issue: 61
• Pages of publication: 34960
• a: 9.8653 ± 0.0003 Å
• b: 16.7612 ± 0.0005 Å
• c: 18.1753 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3005.36 ± 0.15 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0646
• Residual factor for significantly intense reflections: 0.0445
• Weighted residual factors for significantly intense reflections: 0.0805
• Weighted residual factors for all reflections included in the refinement: 0.0865
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No