Information card for entry 7120706

Structure parameters

• Formula: C26 H40 O6 P2
• Calculated formula: C26 H40 O6 P2
• SMILES: P(=O)(OC(C)C)(OC(C)C)Cc1ccc(c2ccc(CP(=O)(OC(C)C)OC(C)C)cc2)cc1
• Title of publication: Facile access to efficiently luminescent Ln3+ phosphonic ester coordination polymers (Ln = Eu, Tb, Dy)
• Authors of publication: Krekić, Kristijan; Klintuch, Dieter; Pietschnig, Rudolf
• Journal of publication: Chem. Commun.
• Year of publication: 2017
• a: 21.8266 ± 0.0018 Å
• b: 5.8487 ± 0.0003 Å
• c: 23.1849 ± 0.0018 Å
• α: 90°
• β: 109.753 ± 0.006°
• γ: 90°
• Cell volume: 2785.6 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 4
• 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: 0.1863
• Residual factor for significantly intense reflections: 0.1503
• Weighted residual factors for significantly intense reflections: 0.4056
• Weighted residual factors for all reflections included in the refinement: 0.4536
• Goodness-of-fit parameter for all reflections included in the refinement: 1.704
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No