Information card for entry 7240147

Structure parameters

• Formula: C30 H63 Cu2 Mo N17 O2
• Calculated formula: C30 H63 Cu2 Mo N17 O2
• Title of publication: Heterobimetallic complexes from 0D cluster to 3D network based-on various polycyanometallates and [Cu(dmpn)2]2+(dmpn = 2,2-dimethyl-1,3-diaminopropane): synthesis, crystal structures and magnetic properties
• Authors of publication: Hao, Xiaoyun; Shi, Jingwen; Dou, Yong; Cao, Tong; Zhou, Zhen; Yang, Lu; Li, Dacheng; Liu, Qingyun; Jiang, Jianzhuang; Zhang, Daopeng
• Journal of publication: CrystEngComm
• Year of publication: 2020
• a: 9.4783 ± 0.0013 Å
• b: 16.388 ± 0.003 Å
• c: 16.592 ± 0.002 Å
• α: 111.53 ± 0.014°
• β: 101.926 ± 0.012°
• γ: 106.101 ± 0.013°
• Cell volume: 2161.9 ± 0.7 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: 0.0667
• Residual factor for significantly intense reflections: 0.047
• Weighted residual factors for significantly intense reflections: 0.0987
• Weighted residual factors for all reflections included in the refinement: 0.1089
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No