Information card for entry 4318023

Structure parameters

• Formula: C27 H53 Cl4 Co N6 O22
• Calculated formula: C27 H53 Cl4 Co N6 O22
• Title of publication: Crown Ether Appended Cyclam Receptors for Cationic Guests
• Authors of publication: Paul V. Bernhardt; Elizabeth J. Hayes
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 2892 - 2902
• a: 11.58 ± 0.003 Å
• b: 14.604 ± 0.001 Å
• c: 25.965 ± 0.007 Å
• α: 90°
• β: 97.36 ± 0.01°
• γ: 90°
• Cell volume: 4354.9 ± 1.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.4982
• Residual factor for significantly intense reflections: 0.1556
• Weighted residual factors for significantly intense reflections: 0.3639
• Weighted residual factors for all reflections included in the refinement: 0.5216
• Goodness-of-fit parameter for all reflections included in the refinement: 0.989
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No