Information card for entry 7122433

Structure parameters

• Formula: C29 H36 B Mo N6 O2 P Si
• Calculated formula: C29 H36 B Mo N6 O2 P Si
• 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: 17.0572 ± 0.0004 Å
• b: 10.5503 ± 0.0002 Å
• c: 17.9411 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3228.65 ± 0.12 ų
• Cell temperature: 150.01 ± 0.01 K
• Ambient diffraction temperature: 150.01 ± 0.01 K
• Number of distinct elements: 8
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0372
• Residual factor for significantly intense reflections: 0.0305
• Weighted residual factors for significantly intense reflections: 0.0657
• Weighted residual factors for all reflections included in the refinement: 0.0696
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No