Information card for entry 4345041

Structure parameters

• Formula: C31 H58 Co K2 N8 O7 S
• Calculated formula: C31 H58 Co K2 N8 O7 S
• Title of publication: Modulating the Primary and Secondary Coordination Spheres within a Series of Co(II)-OH Complexes.
• Authors of publication: Jones, Jason R.; Ziller, Joseph W.; Borovik, A. S.
• Journal of publication: Inorganic chemistry
• Year of publication: 2017
• Journal volume: 56
• Journal issue: 3
• Pages of publication: 1112 - 1120
• a: 11.9841 ± 0.0007 Å
• b: 12.9122 ± 0.0007 Å
• c: 14.8689 ± 0.0008 Å
• α: 68.6652 ± 0.0007°
• β: 87.4545 ± 0.0008°
• γ: 69.8767 ± 0.0007°
• Cell volume: 2003.73 ± 0.19 ų
• Cell temperature: 88 ± 2 K
• Ambient diffraction temperature: 88 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0497
• Residual factor for significantly intense reflections: 0.0378
• Weighted residual factors for significantly intense reflections: 0.0882
• Weighted residual factors for all reflections included in the refinement: 0.0942
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No