Information card for entry 7118346

Structure parameters

• Formula: C58 H72 B2 N4 O P2
• Calculated formula: C58 H72 B2 N4 O P2
• Title of publication: Even the normal is abnormal: N-heterocyclic carbene C(2) binding to a phosphaalkene without breaking the P[double bond, length as m-dash]C π-bond.
• Authors of publication: Majhi, Paresh Kumar; Chow, Keith C. F.; Hsieh, Tom H. H.; Bowes, Eric G.; Schnakenburg, Gregor; Kennepohl, Pierre; Streubel, Rainer; Gates, Derek P.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2016
• Journal volume: 52
• Journal issue: 5
• Pages of publication: 998 - 1001
• a: 25.984 ± 0.002 Å
• b: 9.734 ± 0.001 Å
• c: 21.55 ± 0.002 Å
• α: 90°
• β: 108.32 ± 0.01°
• γ: 90°
• Cell volume: 5174.3 ± 0.9 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.2228
• Residual factor for significantly intense reflections: 0.0776
• Weighted residual factors for significantly intense reflections: 0.1453
• Weighted residual factors for all reflections included in the refinement: 0.1936
• Goodness-of-fit parameter for all reflections included in the refinement: 0.754
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No