Information card for entry 2205233

Structure parameters

• Chemical name: Diaquabis(propane-1,2-diamine-κ^2^N,N')copper(II) terephthalate dihydrate
• Formula: C14 H32 Cu N4 O8
• Calculated formula: C14 H32 Cu N4 O8
• Title of publication: Diaquabis(propane-1,2-diamine-κ^2^<i>N</i>,<i>N</i>')copper(II) terephthalate dihydrate
• Authors of publication: Lin, Zhi-Dong; Liu, Li-Ming; Lu, Jin-Yu; Meng, Xiang-Gao
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 3
• Pages of publication: m590 - m592
• a: 40.922 ± 0.006 Å
• b: 6.8025 ± 0.0009 Å
• c: 15.151 ± 0.002 Å
• α: 90°
• β: 90 ± 0.002°
• γ: 90°
• Cell volume: 4217.6 ± 1 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0569
• Residual factor for significantly intense reflections: 0.0465
• Weighted residual factors for significantly intense reflections: 0.1319
• Weighted residual factors for all reflections included in the refinement: 0.1407
• Goodness-of-fit parameter for all reflections included in the refinement: 1.096
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes