Information card for entry 1501793

Structure parameters

• Formula: C26 H44 F6 O6 P2 Pd S2
• Calculated formula: C26 H44 F6 O6 P2 Pd S2
• SMILES: CC(C)(C)[P]1(C(C)(C)C)Cc2ccccc2C[P](C(C)(C)C)(C(C)(C)C)[Pd]21OS(C(F)(F)F)(=[O]2)=O.C(F)(F)(F)S(=O)(=O)[O-]
• Title of publication: Long-Chain Linear C19and C23Monomers and Polycondensates from Unsaturated Fatty Acid Esters
• Authors of publication: Stempfle, Florian; Quinzler, Dorothee; Heckler, Ilona; Mecking, Stefan
• Journal of publication: Macromolecules
• Year of publication: 2011
• Journal volume: 44
• Journal issue: 11
• Pages of publication: 4159
• a: 9.1472 ± 0.0003 Å
• b: 11.3899 ± 0.0005 Å
• c: 32.6773 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3404.5 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.029
• Residual factor for significantly intense reflections: 0.0253
• Weighted residual factors for significantly intense reflections: 0.0601
• Weighted residual factors for all reflections included in the refinement: 0.0607
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No