Information card for entry 8105573

Structure parameters

• Formula: C57 H54 B Cu F4 N3 P2
• Calculated formula: C57 H54 B Cu F4 N3 P2
• Title of publication: Crystal structure of (2,2′-bipyridine-κ2 N,N′)bis(tri(p-tolyl)phosphine-κP)copper(I) tetrafluoroborate – 4,4′-bipyridine (2/1), C57H54BCuF4N3P2
• Authors of publication: Fazal, Atif; Fettouhi, Mohammed
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2018
• Journal volume: 234
• Journal issue: 1
• Pages of publication: 155 - 157
• a: 11.6379 ± 0.0012 Å
• b: 20.173 ± 0.002 Å
• c: 21.786 ± 0.002 Å
• α: 90°
• β: 97.27 ± 0.002°
• γ: 90°
• Cell volume: 5073.6 ± 0.9 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.0647
• Residual factor for significantly intense reflections: 0.044
• Weighted residual factors for significantly intense reflections: 0.1152
• Weighted residual factors for all reflections included in the refinement: 0.1283
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No