Information card for entry 7211793

Structure parameters

• Formula: C18 H21 Cu N3 O9
• Calculated formula: C18 H21 Cu N3 O9
• Title of publication: Structure and physical properties of substituted malonate divalent metal coordination polymers with dipyridylamine co-ligands: acentric chain, herringbone layer, and novel binodal network topologies
• Authors of publication: Farnum, Gregory A.; Nettleman, Joseph H.; LaDuca, Robert L.
• Journal of publication: CrystEngComm
• Year of publication: 2010
• Journal volume: 12
• Journal issue: 3
• Pages of publication: 888
• a: 20.258 ± 0.003 Å
• b: 4.7728 ± 0.0006 Å
• c: 21.145 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2044.5 ± 0.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.043
• Residual factor for significantly intense reflections: 0.0339
• Weighted residual factors for significantly intense reflections: 0.083
• Weighted residual factors for all reflections included in the refinement: 0.087
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No