Information card for entry 2004672

Structure parameters

• Chemical name: (2,2'-bipyridyl)(methyl)(phenyl)palladium(II)
• Formula: C17 H16 N2 Pd
• Calculated formula: C17 H16 N2 Pd
• SMILES: [Pd]1([n]2c(c3[n]1cccc3)cccc2)(c1ccccc1)C
• Title of publication: A Second Polymorph of 2,2'-Bipyridyl(methyl)(phenyl)palladium(II)
• Authors of publication: Spek, A. L.; Janssen, M. D.; Markies, B. A.; van Koten, G.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1996
• Journal volume: 52
• Journal issue: 4
• Pages of publication: 868 - 871
• a: 25.303 ± 0.003 Å
• b: 9.953 ± 0.004 Å
• c: 25.071 ± 0.003 Å
• α: 90°
• β: 112.08 ± 0.01°
• γ: 90°
• Cell volume: 5851 ± 3 ų
• Cell temperature: 300 K
• Ambient diffraction temperature: 300 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.069
• Weighted residual factors for significantly intense reflections: 0.19
• Goodness-of-fit parameter for significantly intense reflections: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No