Information card for entry 7103561

Structure parameters

• Formula: C46 H46 Co3 N4 O14
• Calculated formula: C46 H46 Co3 N4 O14
• Title of publication: Resin-assisted solvothermal synthesis of metal-organic frameworks.
• Authors of publication: Du, Yi; Thompson, Amber L; O'Hare, Dermot
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2008
• Journal issue: 45
• Pages of publication: 5987 - 5989
• a: 11.3972 ± 0.0002 Å
• b: 18.9914 ± 0.0004 Å
• c: 11.8255 ± 0.0002 Å
• α: 90°
• β: 118.038 ± 0.0007°
• γ: 90°
• Cell volume: 2259.2 ± 0.07 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 5
• 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: 0.0798
• Residual factor for significantly intense reflections: 0.0396
• Weighted residual factors for all reflections: 0.1069
• Weighted residual factors for significantly intense reflections: 0.0933
• Weighted residual factors for all reflections included in the refinement: 0.1069
• Goodness-of-fit parameter for all reflections included in the refinement: 0.8775
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No