Information card for entry 7249479

Structure parameters

• Formula: C18 H15 O2 P
• Calculated formula: C18 H15 O2 P
• Title of publication: Flow electrosynthesis of phosphinamides and phosphoramidates through P–N coupling
• Authors of publication: Boruah, Tribani; Ishizeki, Ren; Roldan, Alberto; Melen, Rebecca L.; Wirth, Thomas
• Journal of publication: Green Chemistry
• Year of publication: 2024
• Journal volume: 26
• Journal issue: 23
• Pages of publication: 11722 - 11727
• a: 9.2605 ± 0.0004 Å
• b: 11.3986 ± 0.0005 Å
• c: 14.1564 ± 0.0005 Å
• α: 90°
• β: 93.665 ± 0.003°
• γ: 90°
• Cell volume: 1491.25 ± 0.11 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 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: 0.0775
• Residual factor for significantly intense reflections: 0.057
• Weighted residual factors for significantly intense reflections: 0.1411
• Weighted residual factors for all reflections included in the refinement: 0.155
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No