Information card for entry 4108893

Structure parameters

• Formula: C22 H16 Co N2 O4
• Calculated formula: C22 H16 Co N2 O4
• Title of publication: Integrated Molecular Chirality, Absolute Helicity, and Intrinsic Chiral Topology in Three-Dimensional Open-Framework Materials
• Authors of publication: Jian Zhang; Shumei Chen; Areg Zingiryan; Xianhui Bu
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2008
• Journal volume: 130
• Pages of publication: 17246 - 17247
• a: 10.4498 ± 0.0005 Å
• b: 10.4498 ± 0.0005 Å
• c: 31.896 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 3016.4 ± 0.3 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 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: 0.0519
• Residual factor for significantly intense reflections: 0.0457
• Weighted residual factors for significantly intense reflections: 0.1225
• Weighted residual factors for all reflections included in the refinement: 0.1261
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No