Information card for entry 7113338

Structure parameters

• Common name: Compound-Co
• Chemical name: Compound-Co
• Formula: C50 H48 Co N10 O4 S2
• Calculated formula: C50 H48 Co N10 O4 S2
• Title of publication: Supramolecular isomerism in multivalent metal-templated assemblies with topochemical influence in the regioselective synthesis of tetrakis(2-pyridyl)cyclobutane isomers.
• Authors of publication: Briceño, Alexander; Leal, Dayana; Atencio, Reinaldo; Díaz de Delgado, Graciela
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2006
• Journal issue: 33
• Pages of publication: 3534 - 3536
• a: 10.6357 ± 0.001 Å
• b: 10.1079 ± 0.0009 Å
• c: 22.888 ± 0.002 Å
• α: 90°
• β: 92.203 ± 0.003°
• γ: 90°
• Cell volume: 2458.7 ± 0.4 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 6
• 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: 0.0977
• Residual factor for significantly intense reflections: 0.0684
• Weighted residual factors for significantly intense reflections: 0.1715
• Weighted residual factors for all reflections included in the refinement: 0.1938
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No