Information card for entry 1564346

Structure parameters

• Formula: C62 H55 Co2 N9 O14.6
• Calculated formula: C62 H55 Co2 N9.001 O14.603
• Title of publication: Crystalline sponge X-ray analysis coupled with supercritical fluid chromatography: a novel analytical platform for the rapid separation, isolation, and characterization of analytes.
• Authors of publication: Taniguchi, Yoshimasa; Miwa, Mayuka; Kitada, Naoki
• Journal of publication: The Analyst
• Year of publication: 2021
• Journal volume: 146
• Journal issue: 17
• Pages of publication: 5230 - 5235
• a: 10.209 ± 0.0001 Å
• b: 24.9298 ± 0.0003 Å
• c: 11.4431 ± 0.0001 Å
• α: 90°
• β: 92.162 ± 0.001°
• γ: 90°
• Cell volume: 2910.29 ± 0.05 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0649
• Residual factor for significantly intense reflections: 0.0642
• Weighted residual factors for significantly intense reflections: 0.1734
• Weighted residual factors for all reflections included in the refinement: 0.1738
• Goodness-of-fit parameter for all reflections included in the refinement: 1.165
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No