Information card for entry 7035807

Structure parameters

• Formula: C76.28 H62 Co8.51 N9.43 O44.45
• Calculated formula: C76.26 H61.94 Co8.513 N9.42 O44.446
• Title of publication: Synthesis of cobalt cluster-based supramolecular triple-stranded helicates.
• Authors of publication: Yoo, Hyojong; Lee, Jeonghee; Kang, Philjae; Choi, Moon-Gun
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 32
• Pages of publication: 14213 - 14216
• a: 23.9077 ± 0.0005 Å
• b: 23.9077 ± 0.0005 Å
• c: 17.2642 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 8545.8 ± 0.4 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 152
• Hermann-Mauguin space group symbol: P 31 2 1
• Hall space group symbol: P 31 2"
• Residual factor for all reflections: 0.083
• Residual factor for significantly intense reflections: 0.0729
• Weighted residual factors for significantly intense reflections: 0.2014
• Weighted residual factors for all reflections included in the refinement: 0.2107
• Goodness-of-fit parameter for all reflections included in the refinement: 1.095
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No