Information card for entry 2209745

Structure parameters

• Chemical name: trans-Diaquabis(5,5-diphenylhydantoinato-κN^3^)copper(II)
• Formula: C30 H26 Cu N4 O6
• Calculated formula: C30 H26 Cu N4 O6
• SMILES: C1(=O)N(C(=O)C(c2ccccc2)(N1)c1ccccc1)[Cu]([OH2])([OH2])N1C(=O)NC(C1=O)(c1ccccc1)c1ccccc1
• Title of publication: <i>trans</i>-Diaquabis(5,5-diphenylhydantoinato-κ<i>N</i>^3^)copper(II)
• Authors of publication: Hu, Xi-Lan; Xu, Xing-You; Wang, Da-Qi; Xu, Tong-Tao
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 8
• Pages of publication: m1922 - m1923
• a: 31.341 ± 0.007 Å
• b: 8.569 ± 0.0019 Å
• c: 11.287 ± 0.003 Å
• α: 90°
• β: 107.411 ± 0.004°
• γ: 90°
• Cell volume: 2892.4 ± 1.2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.0728
• Residual factor for significantly intense reflections: 0.0497
• Weighted residual factors for significantly intense reflections: 0.1221
• Weighted residual factors for all reflections included in the refinement: 0.1362
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes