Information card for entry 4328881

Structure parameters

• Formula: C22 H23 Ag B F4 N5 O
• Calculated formula: C22 H23 Ag B F4 N5 O
• Title of publication: Influence of Second Coordination Sphere Hydroxyl Groups on the Reactivity of Copper(I) Complexes
• Authors of publication: Christopher S. Letko; Thomas B. Rauchfuss; Xiaoyuan Zhou; Danielle L. Gray
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 4511 - 4520
• a: 9.4144 ± 0.0002 Å
• b: 13.7542 ± 0.0004 Å
• c: 18.1509 ± 0.0004 Å
• α: 90°
• β: 95.264 ± 0.001°
• γ: 90°
• Cell volume: 2340.4 ± 0.1 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0322
• Residual factor for significantly intense reflections: 0.0286
• Weighted residual factors for significantly intense reflections: 0.0735
• Weighted residual factors for all reflections included in the refinement: 0.0757
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No