Information card for entry 4126945

Structure parameters

• Formula: C29 H37 Au Cl N2 O2 P
• Calculated formula: C29 H37 Au Cl N2 O2 P
• SMILES: [Au]([P]12C(=C(C=C(C=C1C)C)C)N1C(=O)C(C)(C(=O)N(C1=C2C(C)(C)C)c1c(C)cc(cc1C)C)C)Cl
• Title of publication: A Transient Vinylphosphinidene via a Phosphirene-Phosphinidene Rearrangement.
• Authors of publication: Liu, Liu Leo; Zhou, Jiliang; Cao, Levy L.; Andrews, Ryan; Falconer, Rosalyn L.; Russell, Christopher A.; Stephan, Douglas W.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2017
• a: 9.7089 ± 0.0018 Å
• b: 10.2731 ± 0.0016 Å
• c: 15.289 ± 0.003 Å
• α: 76.522 ± 0.005°
• β: 81.575 ± 0.006°
• γ: 78.255 ± 0.005°
• Cell volume: 1444 ± 0.5 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0244
• Residual factor for significantly intense reflections: 0.0211
• Weighted residual factors for significantly intense reflections: 0.0549
• Weighted residual factors for all reflections included in the refinement: 0.0562
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No