Information card for entry 7232653

Structure parameters

• Formula: C26 H24 N O4 P S
• Calculated formula: C26 H24 N O4 P S
• Title of publication: Highly chemo- and regioselective C‒P cross-coupling reaction of quinone imine ketals with Ar2P(O)H to construct ortho-amino triarylphosphine derivatives
• Authors of publication: Liu, Teng; Li, Yongqin; Cheng, Feixiang; Shen, Xianfu; Liu, Jianjun; Lin, Jun
• Journal of publication: Green Chemistry
• Year of publication: 2019
• Journal volume: 21
• Journal issue: 13
• Pages of publication: 3536
• a: 10.393 ± 0.005 Å
• b: 18.063 ± 0.009 Å
• c: 12.568 ± 0.006 Å
• α: 90°
• β: 99.096 ± 0.01°
• γ: 90°
• Cell volume: 2330 ± 2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• 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: 0.222
• Residual factor for significantly intense reflections: 0.1215
• Weighted residual factors for significantly intense reflections: 0.3121
• Weighted residual factors for all reflections included in the refinement: 0.3678
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No