Information card for entry 1577195

Structure parameters

• Chemical name: {(PPh3)Au[CPN3Bn]}2
• Formula: C11 H16 Au N3 P2
• Calculated formula: C11 H16 Au N3 P2
• Title of publication: Cyaphide Generation at an Aluminium(I) Center: A Useful Precursor for Phosphorus-Containing Heterocycles
• Authors of publication: Yakubenko, Artyom; García-Romero, Álvaro; Urwin, Stephanie; Fernandez, Israel; Goicoechea, Jose M.
• Journal of publication: Chemical Science
• Year of publication: 2026
• a: 17.7846 ± 0.0016 Å
• b: 9.0274 ± 0.0008 Å
• c: 18.6839 ± 0.0016 Å
• α: 90°
• β: 104.408 ± 0.003°
• γ: 90°
• Cell volume: 2905.3 ± 0.4 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 5
• 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: 0.042
• Residual factor for significantly intense reflections: 0.0358
• Weighted residual factors for significantly intense reflections: 0.0911
• Weighted residual factors for all reflections included in the refinement: 0.0936
• Goodness-of-fit parameter for all reflections included in the refinement: 1.166
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No