Information card for entry 2203645

Structure parameters

• Formula: C46 H44 Cu N6 O4
• Calculated formula: C46 H44 Cu N6 O4
• SMILES: [Cu](N1C(=O)NC(C1=O)(c1ccccc1)c1ccccc1)(N1C(=O)NC(C1=O)(c1ccccc1)c1ccccc1)([NH2]CCc1ccccc1)[NH2]CCc1ccccc1
• Title of publication: <i>trans</i>-Bis(5,5-diphenylhydantoinato)bis(2-phenylethylamine)copper(II)
• Authors of publication: Akitsu, Takashiro; Einaga, Yasuaki
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 5
• Pages of publication: m524 - m526
• a: 11.05 ± 0.009 Å
• b: 18.502 ± 0.01 Å
• c: 9.916 ± 0.005 Å
• α: 90°
• β: 95.08 ± 0.05°
• γ: 90°
• Cell volume: 2019 ± 2 ų
• Cell temperature: 297 ± 1 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.0472
• Weighted residual factors for all reflections included in the refinement: 0.1515
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No