Information card for entry 8102075

Structure parameters

• Chemical name: tetrakis(μ-betaine-O,O')dibromo-dicopper(II) dibromide dihydrate
• Formula: C20 H48 Br4 Cu2 N4 O10
• Calculated formula: C20 H48 Br4 Cu2 N4 O10
• Title of publication: Crystal structure of tetrakis(μ-betaine-O,O')dibromodicopper (II) dibromide dihydrate, [Cu~2~{(CH~3~)~3~NCH~2~COO}~4~Br~2~]Br~2~ · 2H~2~O, with a propeller-shaped dinuclear copper complex
• Authors of publication: Wiehl, L.; Schreuer, J.; Stojic, A.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2006
• Journal volume: 221
• Journal issue: 4
• Pages of publication: 527 - 528
• a: 11.3039 ± 0.0007 Å
• b: 14.7663 ± 0.0009 Å
• c: 11.3239 ± 0.0007 Å
• α: 90°
• β: 108.194 ± 0.005°
• γ: 90°
• Cell volume: 1795.7 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0405
• Residual factor for significantly intense reflections: 0.0323
• Weighted residual factors for significantly intense reflections: 0.0818
• Weighted residual factors for all reflections included in the refinement: 0.0846
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No