Information card for entry 4339204

Structure parameters

• Formula: C28 H18 Cu Ge N4 O10
• Calculated formula: C28 H18 Cu Ge N4 O10
• SMILES: C1(=O)C(=O)O[Ge]23(O1)([OH][Cu]14([n]5cccc6c5c5c(cc6)ccc[n]15)([n]1cccc5c1c1c(cc5)ccc[n]41)[OH]3)OC(C(=O)O2)=O
• Title of publication: Heterodimetallic germanium(IV) complex structures with transition metals.
• Authors of publication: Shi, Fa-Nian; Cunha-Silva, Luís; Hardie, Michaele J.; Trindade, Tito; Paz, Filipe A Almeida; Rocha, João
• Journal of publication: Inorganic chemistry
• Year of publication: 2007
• Journal volume: 46
• Journal issue: 16
• Pages of publication: 6502 - 6515
• a: 15.25 ± 0.003 Å
• b: 12.032 ± 0.002 Å
• c: 13.582 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2492.1 ± 0.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 52
• Hermann-Mauguin space group symbol: P n n a
• Hall space group symbol: -P 2a 2bc
• Residual factor for all reflections: 0.1387
• Residual factor for significantly intense reflections: 0.105
• Weighted residual factors for significantly intense reflections: 0.2622
• Weighted residual factors for all reflections included in the refinement: 0.2798
• Goodness-of-fit parameter for all reflections included in the refinement: 1.117
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No