Information card for entry 7013140

Structure parameters

• Common name: (Co(Me6docosadieneN4S2))(ClO4)3.2H2O
• Formula: C22 H46 Cl3 Co N4 O14 S2
• Calculated formula: C22 H42 Cl3 Co N4 O14 S2
• Title of publication: Embracing ligands. A synthetic strategy towards new nitrogen‒thioether multidentate ligands and characterization of the cobalt(III) complexes
• Authors of publication: Clint A. Sharrad; Stefan R. Lüthi; Lawrence R. Gahan
• Journal of publication: Dalton Trans.
• Year of publication: 2003
• Journal issue: 19
• Pages of publication: 3693 - 3703
• a: 12.7 ± 0.001 Å
• b: 16.637 ± 0.001 Å
• c: 16.102 ± 0.002 Å
• α: 90°
• β: 94.7 ± 0.01°
• γ: 90°
• Cell volume: 3390.7 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.3422
• Residual factor for significantly intense reflections: 0.068
• Weighted residual factors for all reflections: 0.1961
• Weighted residual factors for significantly intense reflections: 0.1205
• Goodness-of-fit parameter for all reflections included in the refinement: 0.942
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No