Information card for entry 7012045

Structure parameters

• Formula: C31 H32 I2 P2 Pd
• Calculated formula: C31 H32 I2 P2 Pd
• Title of publication: Didentate phosphine ligands with alkenyl and alkynyl linker units as building blocks for dendrimer fixation
• Authors of publication: Ralf A. Findeis; Lutz H. Gade
• Journal of publication: J. Chem. Soc., Dalton Trans.
• Year of publication: 2002
• Journal issue: 21
• Pages of publication: 3952 - 3960
• a: 12.9006 ± 0.0002 Å
• b: 18.1476 ± 0.0004 Å
• c: 14.2538 ± 0.0004 Å
• α: 90°
• β: 112.264 ± 0.005°
• γ: 90°
• Cell volume: 3088.25 ± 0.16 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 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: 0.063
• Residual factor for significantly intense reflections: 0.029
• Weighted residual factors for all reflections: 0.585
• Weighted residual factors for all reflections included in the refinement: 0.031
• Goodness-of-fit parameter for all reflections: 20.017
• Goodness-of-fit parameter for all reflections included in the refinement: 0.917
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No