Information card for entry 7228047

Structure parameters

• Formula: C30 H25 Cd3 Cl O19
• Calculated formula: C30 H25 Cd3 Cl O19
• Title of publication: Introducing 2-(2-carboxyphenoxy)terephthalic acid as a new versatile building block for design of diverse coordination polymers: Synthesis, structural features, luminescence sensing, and magnetism
• Authors of publication: Gu, Jinzhong; Kirillov, Alexander M.; Liang, Xiaoxiao; Cui, Yanhui; Wu, Jiang; Shi, Zi-Fa
• Journal of publication: CrystEngComm
• Year of publication: 2017
• a: 10.8678 ± 0.0006 Å
• b: 14.2781 ± 0.0009 Å
• c: 14.568 ± 0.0006 Å
• α: 109.047 ± 0.005°
• β: 103.976 ± 0.004°
• γ: 90.04 ± 0.005°
• Cell volume: 2065.7 ± 0.2 ų
• Cell temperature: 294.2 ± 0.3 K
• Ambient diffraction temperature: 294.2 ± 0.3 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0839
• Residual factor for significantly intense reflections: 0.0731
• Weighted residual factors for significantly intense reflections: 0.1765
• Weighted residual factors for all reflections included in the refinement: 0.1812
• Goodness-of-fit parameter for all reflections included in the refinement: 1.14
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No