Information card for entry 1570899

Structure parameters

• Formula: C26 H17 O3 P
• Calculated formula: C26 H17 O3 P
• Title of publication: Luminescent Behavior of Zn(II) and Mn(II) Halide Derivatives of 4-Phenyldinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepine 4-Oxide and Single-Crystal X-ray Structure Determination of the Ligand.
• Authors of publication: Ferraro, Valentina; Castro, Jesús; Bortoluzzi, Marco
• Journal of publication: Molecules (Basel, Switzerland)
• Year of publication: 2024
• Journal volume: 29
• Journal issue: 1
• Pages of publication: 239
• a: 10.1725 ± 0.0003 Å
• b: 10.5825 ± 0.0003 Å
• c: 18.4246 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1983.42 ± 0.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• 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: 0.0277
• Residual factor for significantly intense reflections: 0.0273
• Weighted residual factors for significantly intense reflections: 0.0731
• Weighted residual factors for all reflections included in the refinement: 0.0734
• Goodness-of-fit parameter for all reflections included in the refinement: 1.091
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No