Information card for entry 7702086

Structure parameters

• Formula: C52 H64 B2 N2 P4
• Calculated formula: C52 H64 B2 N2 P4
• Title of publication: PNPCB heterocycles via thermal and Lewis acid catalyzed trans-hydroborations.
• Authors of publication: Fan, Louie; Stephan, Douglas W.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 22
• Pages of publication: 9229 - 9234
• a: 10.3495 ± 0.0007 Å
• b: 15.2609 ± 0.0011 Å
• c: 16.9887 ± 0.0012 Å
• α: 108.455 ± 0.003°
• β: 104.696 ± 0.003°
• γ: 92.445 ± 0.004°
• Cell volume: 2439.8 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 149.97 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: 0.046
• Residual factor for significantly intense reflections: 0.0375
• Weighted residual factors for significantly intense reflections: 0.0971
• Weighted residual factors for all reflections included in the refinement: 0.1041
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No