Information card for entry 7213616

Structure parameters

• Formula: C58 H42 Cu7 N14 Nd3 O22
• Calculated formula: C58 H42 Cu7 N14 Nd3 O22
• Title of publication: A series of three-dimensional 3d‒4f cyanide heterometallic coordination polymers: synthesis, crystal structure, photoluminescent and magnetic properties
• Authors of publication: Ma, Ying-Zhao; Zhang, Li-Min; Peng, Guo; Zhao, Chong-Jian; Dong, Ruo-Ting; Yang, Cheng-Feng; Deng, Hong
• Journal of publication: CrystEngComm
• Year of publication: 2014
• Journal volume: 16
• Journal issue: 4
• Pages of publication: 667
• a: 11.9085 ± 0.0014 Å
• b: 17.017 ± 0.002 Å
• c: 17.936 ± 0.002 Å
• α: 74.992 ± 0.002°
• β: 90.255 ± 0.002°
• γ: 88.732 ± 0.002°
• Cell volume: 3509.6 ± 0.7 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.071
• Residual factor for significantly intense reflections: 0.0454
• Weighted residual factors for significantly intense reflections: 0.0783
• Weighted residual factors for all reflections included in the refinement: 0.0867
• Goodness-of-fit parameter for all reflections included in the refinement: 1.082
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No