Information card for entry 7124818

Structure parameters

• Chemical name: 5,5'-Diphenyl-2,2'-bipyridine
• Formula: C22 H16 N2
• Calculated formula: C22 H16 N2
• Title of publication: Mechanistic insights into the potassium tert-butoxide-mediated synthesis of N-heterobiaryls.
• Authors of publication: Stephens, David E.; Lakey-Beitia, Johant; Burch, Jessica E.; Arman, Hadi D.; Larionov, Oleg V.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2016
• Journal volume: 52
• Journal issue: 64
• Pages of publication: 9945 - 9948
• a: 20.26 ± 0.012 Å
• b: 5.434 ± 0.003 Å
• c: 16.088 ± 0.009 Å
• α: 90°
• β: 110.528 ± 0.009°
• γ: 90°
• Cell volume: 1658.7 ± 1.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• 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: 0.085
• Residual factor for significantly intense reflections: 0.0681
• Weighted residual factors for significantly intense reflections: 0.1391
• Weighted residual factors for all reflections included in the refinement: 0.1491
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No