Information card for entry 4341211

Structure parameters

• Formula: C20 H18 N4 O5
• Calculated formula: C20 H18 N4 O5
• SMILES: c1ccc2c(c3c(cccn3)c3c2[nH]c(c2ccc(cc2)C(=O)O)n3)n1.O.O.O
• Title of publication: Eu-MOFs with 2-(4-Carboxyphenyl)imidazo[4,5-f]-1,10-phenanthroline and Ditopic Carboxylates as Coligands: Synthesis, Structure, High Thermostability, and Luminescence Properties.
• Authors of publication: Zhang, Sheng; Yang, Yang; Xia, Zheng-Qiang; Liu, Xiang-Yu; Yang, Qi; Wei, Qing; Xie, Gang; Chen, San-Ping; Gao, Sheng-Li
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 20
• Pages of publication: 10952 - 10963
• a: 3.7161 ± 0.0008 Å
• b: 24.686 ± 0.005 Å
• c: 21.803 ± 0.004 Å
• α: 90°
• β: 96.552 ± 0.005°
• γ: 90°
• Cell volume: 1987 ± 0.7 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.2126
• Residual factor for significantly intense reflections: 0.0903
• Weighted residual factors for significantly intense reflections: 0.2558
• Weighted residual factors for all reflections included in the refinement: 0.3155
• Goodness-of-fit parameter for all reflections included in the refinement: 1.083
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No