Information card for entry 2240984

Structure parameters

• Chemical name: Bibromidobis(1,3-dibenzyl-1,3-diazinan-2-one-κ<i>O</i>)cobalt(II)
• Formula: C36 H40 Br2 Co N4 O2
• Calculated formula: C36 H40 Br2 Co N4 O2
• Title of publication: Crystal structure of dibromidobis(1,3-dibenzyl-1,3-diazinan-2-one-κ<i>O</i>)cobalt(II)
• Authors of publication: Rais, Eduard; Flörke, Ulrich; Wilhelm, René
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2015
• Journal volume: 71
• Journal issue: 9
• Pages of publication: m160 - m161
• a: 24.182 ± 0.007 Å
• b: 10.744 ± 0.003 Å
• c: 40.003 ± 0.011 Å
• α: 90°
• β: 92.687 ± 0.009°
• γ: 90°
• Cell volume: 10382 ± 5 ų
• Cell temperature: 130 ± 2 K
• Ambient diffraction temperature: 130 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1503
• Residual factor for significantly intense reflections: 0.0525
• Weighted residual factors for significantly intense reflections: 0.0927
• Weighted residual factors for all reflections included in the refinement: 0.1095
• Goodness-of-fit parameter for all reflections included in the refinement: 0.74
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes