Information card for entry 7210180

Structure parameters

• Formula: C16 H16 Cu N5 O12 Tb
• Calculated formula: C16 H16 Cu N5 O12 Tb
• Title of publication: Series of novel 3D microporous heterometallic 3d‒4f coordination frameworks with (5,6)-connected topology: synthesis, crystal structure and magnetic properties
• Authors of publication: Chen, ChuJun; Wang, Ning; Long, Yi; Gao, JinYing; Xie, WeiPing; Ran, XingRui; Yue, ShanTang
• Journal of publication: CrystEngComm
• Year of publication: 2013
• Journal volume: 15
• Journal issue: 23
• Pages of publication: 4611
• a: 10.672 ± 0.0016 Å
• b: 10.7194 ± 0.0016 Å
• c: 11.9351 ± 0.0018 Å
• α: 70.341 ± 0.002°
• β: 77.928 ± 0.002°
• γ: 60.8544 ± 0.001°
• Cell volume: 1121.3 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0453
• Residual factor for significantly intense reflections: 0.0395
• Weighted residual factors for significantly intense reflections: 0.0958
• Weighted residual factors for all reflections included in the refinement: 0.1013
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No