Information card for entry 7236514

Structure parameters

• Formula: C49.5 H49.5 Cd2 N16.5 O13.5
• Calculated formula: C42 H30 Cd2 N14 O10
• Title of publication: Sorption and sensing properties of coordination polymers with mixed 1,3,5-tri(1-imidazolyl)benzene and 2,6-naphthalenedicarboxylate ligands
• Authors of publication: Deng, Ye; Yao, Zhao-Yu; Wang, Peng; Zhao, Yue; Kang, Yan-Shang; Azam, Mohammad; Al-Resayes, Saud I.; Sun, Wei-Yin
• Journal of publication: RSC Advances
• Year of publication: 2017
• Journal volume: 7
• Journal issue: 71
• Pages of publication: 44639
• a: 13.572 ± 0.005 Å
• b: 14.157 ± 0.005 Å
• c: 19.505 ± 0.008 Å
• α: 93.398 ± 0.011°
• β: 110.063 ± 0.009°
• γ: 90.003 ± 0.01°
• Cell volume: 3513 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.1494
• Residual factor for significantly intense reflections: 0.1021
• Weighted residual factors for significantly intense reflections: 0.2452
• Weighted residual factors for all reflections included in the refinement: 0.2695
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No