Information card for entry 2230119

Structure parameters

• Chemical name: Bis{μ~3~-<i>cis</i>-<i>N</i>-(2-carboxylato-5-chlorophenyl)-<i>N</i>'- [3-(dimethylamino)propyl]oxamidato(3-)}bis(perchlorato- κ<i>O</i>)bis(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'- tetramethylethylenediamine)tetracopper(II)
• Formula: C40 H62 Cl4 Cu4 N10 O16
• Calculated formula: C40 H62 Cl4 Cu4 N10 O16
• Title of publication: Bis{μ~3~-<i>cis</i>-<i>N</i>-(2-carboxylato-5-chlorophenyl)-<i>N</i>'-[3-(dimethylamino)propyl]oxamidato(3{-})}bis(perchlorato-κ<i>O</i>)bis(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylethylenediamine)tetracopper(II)
• Authors of publication: Sun, Yanlong; Xu, Xuelian
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 5
• Pages of publication: m645 - m646
• a: 12.575 ± 0.0013 Å
• b: 16.4137 ± 0.0019 Å
• c: 14.108 ± 0.0015 Å
• α: 90°
• β: 113.988 ± 0.002°
• γ: 90°
• Cell volume: 2660.4 ± 0.5 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0734
• Residual factor for significantly intense reflections: 0.0444
• Weighted residual factors for significantly intense reflections: 0.1095
• Weighted residual factors for all reflections included in the refinement: 0.1326
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes