Information card for entry 4314647

Structure parameters

• Formula: C57 H86 Cl N7 O15
• Calculated formula: C57 H74 Cl N7 O15
• Title of publication: A Versatile Tripodal Amide Receptor for the Encapsulation of Anions or Hydrated Anions via Formation of Dimeric Capsules
• Authors of publication: M. Arunachalam; Pradyut Ghosh
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 943 - 951
• a: 13.0744 ± 0.0006 Å
• b: 13.6103 ± 0.0006 Å
• c: 17.461 ± 0.0008 Å
• α: 72.951 ± 0.001°
• β: 82.758 ± 0.001°
• γ: 88.231 ± 0.001°
• Cell volume: 2946.8 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1193
• Residual factor for significantly intense reflections: 0.0862
• Weighted residual factors for significantly intense reflections: 0.2332
• Weighted residual factors for all reflections included in the refinement: 0.2635
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No