Information card for entry 4332959

Structure parameters

• Formula: C46 H45 Cu4 N15 O0 S6 W
• Calculated formula: C46 H45 Cu4 N15 S6 W
• Title of publication: Synthesis and Crystal Structures of Multidimensional Coordination Polymers Based on W/Cu/S Clusters with Flexible Imidazole Ligands
• Authors of publication: Song, Li; Li, Jianrong; Lin, Ping; Li, Zhihua; Li, Tao; Du, Shaowu; Wu, Xintao
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 25
• Pages of publication: 10155 - 10161
• a: 12.2328 ± 0.0005 Å
• b: 25.3056 ± 0.0011 Å
• c: 17.4975 ± 0.0008 Å
• α: 90°
• β: 92.616 ± 0.002°
• γ: 90°
• Cell volume: 5410.9 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.0326
• Weighted residual factors for significantly intense reflections: 0.0628
• Weighted residual factors for all reflections included in the refinement: 0.0644
• Goodness-of-fit parameter for all reflections included in the refinement: 1.156
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No