Information card for entry 2225306

Structure parameters

• Chemical name: μ-Succinato-bis[aqua(2,2':6',2''-terpyridine)copper(II)] dinitrate dihydrate
• Formula: C34 H34 Cu2 N8 O14
• Calculated formula: C34 H34 Cu2 N8 O14
• SMILES: c1cccc2c3cccc4[n]3[Cu]([n]12)([n]1c4cccc1)(OC(=O)CCC(=O)O[Cu]12([n]3ccccc3c3cccc([n]13)c1cccc[n]21)[OH2])[OH2].N(=O)(=O)[O-].O.N(=O)(=O)[O-].O
• Title of publication: μ-Succinato-bis[aqua(2,2':6',2''-terpyridine)copper(II)] dinitrate dihydrate
• Authors of publication: Mei, Chongzhen; Lei, Qingduo; Zhang, Peng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 3
• Pages of publication: m346 - m347
• a: 7.397 ± 0.004 Å
• b: 10.65 ± 0.005 Å
• c: 12.574 ± 0.006 Å
• α: 70.196 ± 0.009°
• β: 83.512 ± 0.009°
• γ: 83.836 ± 0.01°
• Cell volume: 923.5 ± 0.8 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0544
• Residual factor for significantly intense reflections: 0.052
• Weighted residual factors for significantly intense reflections: 0.1342
• Weighted residual factors for all reflections included in the refinement: 0.1367
• Goodness-of-fit parameter for all reflections included in the refinement: 0.984
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes