Information card for entry 2231406

Structure parameters

• Chemical name: μ-Bromido-bis{μ-2,2'-[4,7-diazadecane-1,10- diylbis(nitrilomethanylylidene)]diphenolato}tricopper(II) bromide dimethylformamide disolvate
• Formula: C50 H70 Br2 Cu3 N10 O6
• Calculated formula: C50 H70 Br2 Cu3 N10 O6
• Title of publication: μ-Bromido-bis{μ-2,2'-[4,7-diazadecane-1,10-diylbis(nitrilomethanylylidene)]diphenolato}tricopper(II) bromide dimethylformamide disolvate
• Authors of publication: Assey, Gervas; Butcher, Ray J.; Gultneh, Yilma
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 9
• Pages of publication: m1197 - m1198
• a: 18.745 ± 0.0002 Å
• b: 18.745 ± 0.0002 Å
• c: 28.2531 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 8597.4 ± 0.2 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 6
• Space group number: 169
• Hermann-Mauguin space group symbol: P 61
• Hall space group symbol: P 61
• Residual factor for all reflections: 0.0477
• Residual factor for significantly intense reflections: 0.0302
• Weighted residual factors for significantly intense reflections: 0.0594
• Weighted residual factors for all reflections included in the refinement: 0.0619
• Goodness-of-fit parameter for all reflections included in the refinement: 0.909
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes