Information card for entry 2210243

Structure parameters

• Chemical name: Hexaamminecobalt(III)‒4-hydroxybenzenesulfonate‒chloride‒water (3/8/1/13)
• Formula: C48 H120 Cl Co3 N18 O45 S8
• Calculated formula: C48 H120 Cl Co3 N18 O45 S8
• Title of publication: Hexaamminecobalt(III)‒4-hydroxybenzenesulfonate‒chloride‒water (3/8/1/13)
• Authors of publication: Sharma, Raj Pal; Bala, Ritu; Sharma, Rajni; Bond, Andrew D.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 9
• Pages of publication: m2113 - m2115
• a: 22.98 ± 0.001 Å
• b: 7.8559 ± 0.0003 Å
• c: 26.5747 ± 0.0011 Å
• α: 90°
• β: 111.203 ± 0.002°
• γ: 90°
• Cell volume: 4472.7 ± 0.3 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1046
• Residual factor for significantly intense reflections: 0.0689
• Weighted residual factors for significantly intense reflections: 0.1535
• Weighted residual factors for all reflections included in the refinement: 0.165
• Goodness-of-fit parameter for all reflections included in the refinement: 1.114
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes