Information card for entry 7158398

Structure parameters

• Formula: C76 H70 N2 O12
• Calculated formula: C76 H70 N2 O12
• Title of publication: Dissipative control of the fluorescence of a 1,3-dipyrenyl calix[4]arene in the cone conformation.
• Authors of publication: Spatola, Emanuele; Rispoli, Francesco; Del Giudice, Daniele; Cacciapaglia, Roberta; Casnati, Alessandro; Marchiò, Luciano; Baldini, Laura; Di Stefano, Stefano
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2021
• Journal volume: 20
• Journal issue: 1
• Pages of publication: 132 - 138
• a: 14.238 ± 0.003 Å
• b: 14.993 ± 0.003 Å
• c: 15.638 ± 0.002 Å
• α: 70.194 ± 0.007°
• β: 85.592 ± 0.007°
• γ: 77.672 ± 0.008°
• Cell volume: 3068.3 ± 1 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 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: 0.1757
• Residual factor for significantly intense reflections: 0.079
• Weighted residual factors for significantly intense reflections: 0.1737
• Weighted residual factors for all reflections included in the refinement: 0.2211
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No