Information card for entry 8102691

Structure parameters

• Chemical name: Diiodo(1,10-phenanthroline-κ^2^N,N')palladium(II)
• Formula: C12 H8 I2 N2 Pd
• Calculated formula: C12 H8 I2 N2 Pd
• SMILES: [Pd]1([n]2cccc3ccc4ccc[n]1c4c23)(I)I
• Title of publication: Crystal structure of diiodo(1,10-phenanthroline-k2N,N')palladium(II), PdI2(C12H8N2)
• Authors of publication: Kwang Ha
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2010
• Journal volume: 225
• Journal issue: 2
• Pages of publication: 317
• a: 10.3552 ± 0.0007 Å
• b: 18.0162 ± 0.0012 Å
• c: 7.3535 ± 0.0005 Å
• α: 90°
• β: 108.659 ± 0.002°
• γ: 90°
• Cell volume: 1299.77 ± 0.15 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 5
• 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: 0.1104
• Residual factor for significantly intense reflections: 0.0425
• Weighted residual factors for significantly intense reflections: 0.069
• Weighted residual factors for all reflections included in the refinement: 0.093
• Goodness-of-fit parameter for all reflections included in the refinement: 0.924
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No