Information card for entry 7110626

Structure parameters

• Formula: C74 H97 B Co N4 O8
• Calculated formula: C74 H97 B Co N4 O8
• 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: 16.491 ± 0.008 Å
• b: 19.048 ± 0.011 Å
• c: 12.838 ± 0.006 Å
• α: 98.79 ± 0.05°
• β: 97.26 ± 0.04°
• γ: 114.35 ± 0.04°
• Cell volume: 3550 ± 4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.2402
• Residual factor for significantly intense reflections: 0.063
• Weighted residual factors for significantly intense reflections: 0.1592
• Weighted residual factors for all reflections included in the refinement: 0.2251
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No