Information card for entry 4312057

Structure parameters

• Formula: C26 H33 Cl4 Ga N2 P
• Calculated formula: C26 H33 Cl4 Ga N2 P
• Title of publication: Computational Insights into the Acceptor Chemistry of Phosphenium Cations
• Authors of publication: Bobby D. Ellis; Paul J. Ragogna; Charles L. B. Macdonald
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 7857 - 7867
• a: 16.8 ± 0.02 Å
• b: 20.748 ± 0.006 Å
• c: 19.343 ± 0.008 Å
• α: 90°
• β: 114.76 ± 0.04°
• γ: 90°
• Cell volume: 6122 ± 8 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/a 1
• Hall space group symbol: -P 2yab
• Residual factor for all reflections: 0.3244
• Residual factor for significantly intense reflections: 0.0745
• Weighted residual factors for significantly intense reflections: 0.2086
• Weighted residual factors for all reflections included in the refinement: 0.2798
• Goodness-of-fit parameter for all reflections included in the refinement: 1.082
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No