Information card for entry 7719060

Structure parameters

• Formula: C109 H120 Cl4 N2 P2
• Calculated formula: C109 H120 Cl4 N2 P2
• 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: 12.8269 ± 0.0004 Å
• b: 14.3972 ± 0.0005 Å
• c: 27.9842 ± 0.001 Å
• α: 97.129 ± 0.002°
• β: 96.066 ± 0.002°
• γ: 110.97 ± 0.001°
• Cell volume: 4725.1 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0817
• Residual factor for significantly intense reflections: 0.0651
• Weighted residual factors for significantly intense reflections: 0.1452
• Weighted residual factors for all reflections included in the refinement: 0.1535
• Goodness-of-fit parameter for all reflections included in the refinement: 1.078
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No