Information card for entry 2200277

Structure parameters

• Chemical name: [1,2-bis(diphenylphosphino)ethane-P,P]diiodopalladium(II)
• Formula: C26 H24 I2 P2 Pd
• Calculated formula: C26 H24 I2 P2 Pd
• SMILES: [Pd]1(I)(I)[P](CC[P]1(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Solvent-free [1,2-bis(diphenylphosphino)ethane-<i>P</i>,<i>P</i>']diiodopalladium(II)
• Authors of publication: Batsanov, Andrei S.; Howard, Judith A. K.; Robertson, Graham S.; Kilner, Melvin
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2001
• Journal volume: 57
• Journal issue: 6
• Pages of publication: m235 - m236
• a: 9.465 ± 0.001 Å
• b: 19.821 ± 0.001 Å
• c: 14.208 ± 0.001 Å
• α: 90°
• β: 105.51 ± 0.01°
• γ: 90°
• Cell volume: 2568.4 ± 0.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0617
• Residual factor for significantly intense reflections: 0.0405
• Weighted residual factors for all reflections included in the refinement: 0.0803
• Goodness-of-fit parameter for all reflections included in the refinement: 1.157
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes