Information card for entry 7719055

Structure parameters

• Formula: C39.2 H38.1 Cl0.15 N1.85 P
• Calculated formula: C35.7 H34.1 Cl0.15 N1.85 P
• Title of publication: The investigation of the steric hindrance of anilines by means of reactions with PCl₃ and BCl₃.
• Authors of publication: Němec, Vlastimil; Samsonov, Maksim A.; Růžičková, Zdeňka; Vrána, Jan; Růžička, Aleš
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 31
• Pages of publication: 11845 - 11856
• a: 21.3526 ± 0.0014 Å
• b: 14.6647 ± 0.0008 Å
• c: 20.2235 ± 0.0015 Å
• α: 90°
• β: 107.159 ± 0.003°
• γ: 90°
• Cell volume: 6050.7 ± 0.7 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0685
• Residual factor for significantly intense reflections: 0.0537
• Weighted residual factors for significantly intense reflections: 0.1381
• Weighted residual factors for all reflections included in the refinement: 0.1511
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No