Information card for entry 2229640

Structure parameters

• Chemical name: Aquabromidobis(dimethylglyoximato)cobalt(III)
• Formula: C8 H16 Br Co N4 O5
• Calculated formula: C8 H16 Br Co N4 O5
• SMILES: C1(C(C)=N([Co]2(N=1=O)([N](=C(C(C)=[N]2O)C)O)([OH2])Br)=O)C
• Title of publication: Aquabromidobis(dimethylglyoximato)cobalt(III)
• Authors of publication: Meera, Parthasarathy; Amutha Selvi, Madhavan; Jothi, Pachaimuthu; Dayalan, Arunachalam
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 4
• Pages of publication: m442 - m443
• a: 7.5903 ± 0.0003 Å
• b: 8.8816 ± 0.0004 Å
• c: 10.5343 ± 0.0005 Å
• α: 90°
• β: 96.137 ± 0.003°
• γ: 90°
• Cell volume: 706.09 ± 0.05 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.0402
• Residual factor for significantly intense reflections: 0.0338
• Weighted residual factors for significantly intense reflections: 0.0907
• Weighted residual factors for all reflections included in the refinement: 0.0955
• Goodness-of-fit parameter for all reflections included in the refinement: 1.221
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes