Information card for entry 2200540

Structure parameters

• Chemical name: μ-Succinato-bis[aquanitrato(1,10-phenanthroline)copper(II)]
• Formula: C28 H24 Cu2 N6 O12
• Calculated formula: C28 H24 Cu2 N6 O12
• SMILES: c1[n]2c3c(cc1)ccc1ccc[n]([Cu]2(OC(=O)CCC(=O)O[Cu]2([n]4cccc5ccc6ccc[n]2c6c45)(ON(=O)=O)[OH2])(ON(=O)=O)[OH2])c31
• Title of publication: μ-Succinato-bis[aquanitrato(1,10-phenanthroline)copper(II)]
• Authors of publication: Long, La-Sheng; Wang, Peng-Ju; Chen, Xiao-Yun; Fang, Xue-Ming; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2001
• Journal volume: 57
• Journal issue: 8
• Pages of publication: m328 - m330
• a: 6.94 ± 0.001 Å
• b: 10.351 ± 0.002 Å
• c: 10.857 ± 0.002 Å
• α: 69.72 ± 0.03°
• β: 81.28 ± 0.03°
• γ: 75.75 ± 0.03°
• Cell volume: 707.2 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.071
• Residual factor for significantly intense reflections: 0.053
• Weighted residual factors for all reflections included in the refinement: 0.124
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes