Information card for entry 4329476

Structure parameters

• Formula: C42 H34 Cl4 O4 P2 Pu
• Calculated formula: C42 H34 Cl4 O4 P2 Pu
• SMILES: [Pu]1(Cl)(Cl)(Cl)(Cl)[O]=P(c2ccccc2)(c2ccccc2)Cc2cccc3c2oc2c3cccc2CP(=[O]1)(c1ccccc1)c1ccccc1.O1CCCC1
• Title of publication: Synthesis and Coordination Chemistry of Phosphine Oxide Decorated Dibenzofuran Platforms
• Authors of publication: Daniel Rosario-Amorin; Eileen N. Duesler; Robert T. Paine; Benjamin P. Hay; Laetitia H. Delmau; Sean D. Reilly; Andrew J. Gaunt; Brian L. Scott
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 6667 - 6681
• a: 20.108 ± 0.005 Å
• b: 11.7 ± 0.003 Å
• c: 35.766 ± 0.009 Å
• α: 90°
• β: 92.087 ± 0.003°
• γ: 90°
• Cell volume: 8409 ± 4 ų
• Cell temperature: 120 ± 1 K
• Ambient diffraction temperature: 120 ± 1 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1739
• Residual factor for significantly intense reflections: 0.0846
• Weighted residual factors for significantly intense reflections: 0.2063
• Weighted residual factors for all reflections included in the refinement: 0.242
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No