Information card for entry 7110627

Structure parameters

• Formula: C75 H97 B Cl4 Co N4 O7
• Calculated formula: C75 H97 B Cl4 Co N4 O7
• Title of publication: Structures of [Co(II)(L)(NO3)(HOCH3)n]BPh4 (n = 4, 5) complexes (L = cis,cis-1,3,5-triaminocyclohexane-based ligand): structural ‘snapshots’ of anion binding to a metal centre
• Authors of publication: Boxwell, Clive J.; Walton, Paul H.
• Journal of publication: Chemical Communications
• Year of publication: 1999
• Journal issue: 17
• Pages of publication: 1647
• a: 10.393 ± 0.004 Å
• b: 16.811 ± 0.005 Å
• c: 21.737 ± 0.005 Å
• α: 90°
• β: 97.21 ± 0.02°
• γ: 90°
• Cell volume: 3768 ± 2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.1932
• Residual factor for significantly intense reflections: 0.064
• Weighted residual factors for significantly intense reflections: 0.1598
• Weighted residual factors for all reflections included in the refinement: 0.2319
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No