Information card for entry 2201496

Structure parameters

• Chemical name: Bis[μ-bis(4-nitrophenyl) phosphate-κ^2^O:O]bis[(4,4'-dimethyl-2,2'-bipyridine)nitratocopper(II)]
• Formula: C48 H40 Cu2 N10 O22 P2
• Calculated formula: C48 H40 Cu2 N10 O22 P2
• SMILES: c12cc(cc[n]1[Cu]1([O]=P(Oc3ccc(cc3)N(=O)=O)(Oc3ccc(cc3)N(=O)=O)O[Cu]3([n]4ccc(cc4c4cc(cc[n]34)C)C)([O]=P(Oc3ccc(cc3)N(=O)=O)(Oc3ccc(cc3)N(=O)=O)O1)ON(=O)=O)(ON(=O)=O)[n]1ccc(cc21)C)C
• Title of publication: Bis[μ-bis(4-nitrophenyl) phosphato-κ^2^<i>O</i>:<i>O</i>]bis[(4,4'-dimethyl-2,2'-bipyridine)nitratocopper(II)]
• Authors of publication: Deschamps, Jeffrey R.; Hartshorn, Christopher M.; Chang, Eddie L.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 10
• Pages of publication: m606 - m608
• a: 10.9572 ± 0.0005 Å
• b: 11.5226 ± 0.0006 Å
• c: 12.0697 ± 0.0011 Å
• α: 96.159 ± 0.005°
• β: 96.421 ± 0.007°
• γ: 113.044 ± 0.004°
• Cell volume: 1374.33 ± 0.17 ų
• Cell temperature: 198 ± 2 K
• Ambient diffraction temperature: 198 ± 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: 0.0439
• Residual factor for significantly intense reflections: 0.0359
• Weighted residual factors for significantly intense reflections: 0.0906
• Weighted residual factors for all reflections included in the refinement: 0.0958
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes