Information card for entry 7104649

Structure parameters

• Formula: C52 H77 N5 O4
• Calculated formula: C51.9965 H77 N5 O4
• Title of publication: Anion receptors based on 7,7'-diamido-2,2'-diindolylmethane.
• Authors of publication: Dydio, Paweł; Zieliński, Tomasz; Jurczak, Janusz
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2009
• Journal volume: 34
• Journal issue: 30
• Pages of publication: 4560 - 4562
• a: 13.4563 ± 0.001 Å
• b: 13.7844 ± 0.0011 Å
• c: 27.517 ± 0.002 Å
• α: 101.614 ± 0.007°
• β: 100.781 ± 0.007°
• γ: 94.217 ± 0.006°
• Cell volume: 4878.4 ± 0.7 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: 0.1031
• Residual factor for significantly intense reflections: 0.0425
• Weighted residual factors for significantly intense reflections: 0.0949
• Weighted residual factors for all reflections included in the refinement: 0.1073
• Goodness-of-fit parameter for all reflections included in the refinement: 0.827
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No