Information card for entry 7028768

Structure parameters

• Formula: C36 H36 Cu N6 Na O2
• Calculated formula: C36 H36 Cu N6 Na O2
• SMILES: [Na]123([O]4CCCC4)([n]45[Cu]6([n]7ccccc7c4ccc5c4[n]1cccc4)[n]12c(ccc1c1[n]3cccc1)c1[n]6cccc1)[O]1CCCC1
• Title of publication: Multi-nuclear silver(i) and copper(i) complexes: a novel bonding mode for bispyridylpyrrolides.
• Authors of publication: Hu, Xiao-Hui; Liang, Yan; Li, Chen; Yi, Xiao-Yi
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 6
• Pages of publication: 2458 - 2464
• a: 11.6882 ± 0.0003 Å
• b: 30.6434 ± 0.0008 Å
• c: 18.0484 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6464.3 ± 0.3 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 6
• Space group number: 43
• Hermann-Mauguin space group symbol: F d d 2
• Hall space group symbol: F 2 -2d
• Residual factor for all reflections: 0.018
• Residual factor for significantly intense reflections: 0.0178
• Weighted residual factors for significantly intense reflections: 0.053
• Weighted residual factors for all reflections included in the refinement: 0.0532
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No