Information card for entry 1506161

Structure parameters

• Formula: C50 H64 O8
• Calculated formula: C50 H46 O8
• Title of publication: CsF-promoted acetyl dance at the narrow rim of p-tert-butyl[3.1.3.1]homooxacalixarene.
• Authors of publication: Masci, Bernardo; Levi Mortera, Stefano; Persiani, Daniela; Thuéry, Pierre
• Journal of publication: Organic letters
• Year of publication: 2006
• Journal volume: 8
• Journal issue: 20
• Pages of publication: 4405 - 4408
• a: 26.437 ± 0.003 Å
• b: 9.373 ± 0.0011 Å
• c: 19.0763 ± 0.0016 Å
• α: 90°
• β: 105.419 ± 0.007°
• γ: 90°
• Cell volume: 4556.9 ± 0.9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 3
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.155
• Residual factor for significantly intense reflections: 0.1311
• Weighted residual factors for significantly intense reflections: 0.3004
• Weighted residual factors for all reflections included in the refinement: 0.3126
• Goodness-of-fit parameter for all reflections included in the refinement: 1.097
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No