Information card for entry 4314645

Structure parameters

• Formula: C51 H77 N7 O15
• Calculated formula: C51 H50 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: 12.484 ± 0.004 Å
• b: 13.781 ± 0.004 Å
• c: 16.753 ± 0.006 Å
• α: 85.776 ± 0.019°
• β: 73.55 ± 0.018°
• γ: 72.3 ± 0.02°
• Cell volume: 2633.1 ± 1.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1579
• Residual factor for significantly intense reflections: 0.0989
• Weighted residual factors for significantly intense reflections: 0.2734
• Weighted residual factors for all reflections included in the refinement: 0.3212
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No