Information card for entry 1563388

Structure parameters

• Formula: C9 H14 Cu2 Mo4 N6 O13
• Calculated formula: C9 H14 Cu2 Mo4 N6 O13
• Title of publication: Three 3D hybrid networks based on octamolybdates and different CuI/CuII-bis(triazole) motifs
• Authors of publication: Zhang, Chun-Jing; Pang, Hai-Jun; Tang, Qun; Wang, Hui-Yuan; Chen, Ya-Guang
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 2010
• Journal volume: 183
• Journal issue: 12
• Pages of publication: 2945 - 2950
• a: 11.585 ± 0.001 Å
• b: 15.389 ± 0.001 Å
• c: 11.87 ± 0.002 Å
• α: 90°
• β: 100.829 ± 0.001°
• γ: 90°
• Cell volume: 2078.5 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0548
• Residual factor for significantly intense reflections: 0.0379
• Weighted residual factors for significantly intense reflections: 0.1027
• Weighted residual factors for all reflections included in the refinement: 0.1169
• Goodness-of-fit parameter for all reflections included in the refinement: 1.094
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No