Information card for entry 7121323

Structure parameters

• Formula: C29 H44 N2 P2
• Calculated formula: C29 H44 N2 P2
• Title of publication: Phosphaalkene-substituted organo-group 15 compounds: synthesis and characterisation of (NHC)P-EtBu₂ (E = P, As, Sb and Bi).
• Authors of publication: Balmer, Markus; Gottschling, Hannah; von Hänisch, Carsten
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2018
• Journal volume: 54
• Journal issue: 21
• Pages of publication: 2659 - 2661
• a: 9.7612 ± 0.0004 Å
• b: 24.4504 ± 0.001 Å
• c: 14.3595 ± 0.0006 Å
• α: 90°
• β: 94.6105 ± 0.0015°
• γ: 90°
• Cell volume: 3416 ± 0.2 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0419
• Residual factor for significantly intense reflections: 0.0381
• Weighted residual factors for significantly intense reflections: 0.1042
• Weighted residual factors for all reflections included in the refinement: 0.1069
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No