Information card for entry 7124965

Structure parameters

• Formula: C49 H61 N2 O P Sn
• Calculated formula: C49 H61 N2 O P Sn
• Title of publication: N-Heterocyclic carbene phosphaketene adducts as precursors to carbene-phosphinidene adducts and a rearranged π-system.
• Authors of publication: Li, Zhongshu; Chen, Xiaodan; Li, Yaqi; Su, Cheng-Yong; Grützmacher, Hansjörg
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2016
• Journal volume: 52
• Journal issue: 76
• Pages of publication: 11343 - 11346
• a: 10.64809 ± 0.00019 Å
• b: 11.6076 ± 0.0002 Å
• c: 19.4163 ± 0.0003 Å
• α: 91.4216 ± 0.0014°
• β: 92.8956 ± 0.0014°
• γ: 110.289 ± 0.0017°
• Cell volume: 2245.77 ± 0.07 ų
• Cell temperature: 292.34 ± 0.1 K
• Ambient diffraction temperature: 292.34 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0352
• Residual factor for significantly intense reflections: 0.0341
• Weighted residual factors for significantly intense reflections: 0.094
• Weighted residual factors for all reflections included in the refinement: 0.0952
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No