Information card for entry 8101953

Structure parameters

• Chemical name: dimethanol-bis(1,3-bis(3,5-dimethylpyrazol-1-yl)propan-2-olato)- dicopper(II) dibromide
• Formula: C28 H46 Br2 Cu2 N8 O4
• Calculated formula: C28 H46 Br2 Cu2 N8 O4
• Title of publication: Crystal structure of dimethanol-bis(1,3-bis(3,5-dimethylpyrazol-1- yl)-propan-2-olato)dicopper(II) dibromide, [Cu~2~(C~13~H~19~N~4~O) ~2~(CH~3~OH)~2~]Br~2~
• Authors of publication: Zhang, G.-F.; Dou, Y.-L.; She, J.-B.; Yin, M.-H.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2006
• Journal volume: 221
• Journal issue: 2
• Pages of publication: 181 - 182
• a: 11.914 ± 0.004 Å
• b: 16.368 ± 0.005 Å
• c: 18.237 ± 0.006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3556 ± 2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.1061
• Residual factor for significantly intense reflections: 0.0602
• Weighted residual factors for significantly intense reflections: 0.1489
• Weighted residual factors for all reflections included in the refinement: 0.1846
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No