Information card for entry 1571197

Structure parameters

• Common name: Compound_26
• Chemical name: Compound_26
• Formula: C14 H14 N2 O P
• Calculated formula: C14 H14 N2 O P
• Title of publication: Electrosynthesis of iminophosphoranes and applications in nickel catalysis.
• Authors of publication: Mdluli, Velabo; Lehnherr, Dan; Lam, Yu-Hong; Chaudhry, Mohammad T.; Newman, Justin A.; DaSilva, Jimmy O.; Regalado, Erik L.
• Journal of publication: Chemical science
• Year of publication: 2024
• Journal volume: 15
• Journal issue: 16
• Pages of publication: 5980 - 5992
• a: 24.4855 ± 0.0004 Å
• b: 24.4855 ± 0.0004 Å
• c: 11.1476 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 5788.02 ± 0.17 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.0445
• Residual factor for significantly intense reflections: 0.0421
• Weighted residual factors for significantly intense reflections: 0.1208
• Weighted residual factors for all reflections included in the refinement: 0.1229
• Goodness-of-fit parameter for all reflections included in the refinement: 1.102
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No