Information card for entry 1519536

Structure parameters

• Formula: C30 H54 Co2 F12 N20 O16 S4
• Calculated formula: C30 H54 Co2 F12 N20 O16 S4
• Title of publication: C30H54Co2F12N20O16S4
• Authors of publication: Matthews, Craig J.; Horton, Peter N.; Hursthouse, Michael B.
• Journal of publication: Crystal Structure Report Archive
• Year of publication: 2003
• Pages of publication: 983
• a: 18.8487 ± 0.0004 Å
• b: 17.6656 ± 0.0004 Å
• c: 17.0546 ± 0.0004 Å
• α: 90°
• β: 104.054 ± 0.001°
• γ: 90°
• Cell volume: 5508.8 ± 0.2 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0822
• Residual factor for significantly intense reflections: 0.0549
• Weighted residual factors for significantly intense reflections: 0.1233
• Weighted residual factors for all reflections included in the refinement: 0.1389
• 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: Yes
• Has Fobs: No