Information card for entry 7122430

Structure parameters

• Formula: C26 H34 B N6 O2 P W
• Calculated formula: C26 H34 B N6 O2 P W
• Title of publication: Alkynylbis(alkylidynyl)phosphines: {L_nM[triple bond, length as m-dash]C}₂PC[triple bond, length as m-dash]CR.
• Authors of publication: Frogley, Benjamin J.; Hill, Anthony F.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2018
• Journal volume: 54
• Journal issue: 87
• Pages of publication: 12373 - 12376
• a: 15.073 ± 0.0004 Å
• b: 20.533 ± 0.0005 Å
• c: 20.5731 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6367.2 ± 0.3 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150 ± 0.1 K
• Number of distinct elements: 7
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0709
• Residual factor for significantly intense reflections: 0.058
• Weighted residual factors for significantly intense reflections: 0.1504
• Weighted residual factors for all reflections included in the refinement: 0.1676
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No