Information card for entry 7135047

Structure parameters

• Formula: C46 H32 O3 P2
• Calculated formula: C46 H32 O3 P2
• Title of publication: β-Carboxyphospholes <i>via</i> carboxylative desilylation: luminophores with a versatile connectivity attached.
• Authors of publication: Eichhorn, Katharina; Bruhn, Clemens; Pietschnig, Rudolf
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2025
• Journal volume: 61
• Journal issue: 88
• Pages of publication: 17129 - 17132
• a: 11.0559 ± 0.0004 Å
• b: 16.5376 ± 0.0005 Å
• c: 18.8101 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3439.2 ± 0.2 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 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: 0.0431
• Residual factor for significantly intense reflections: 0.0346
• Weighted residual factors for significantly intense reflections: 0.0767
• Weighted residual factors for all reflections included in the refinement: 0.0808
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No