Information card for entry 1512267

Structure parameters

• Formula: C24 H14
• Calculated formula: C24 H14
• SMILES: c12[C@@H]3c4ccc(cc4[C@@H](c4ccc(cc34)C#C)c2cccc1)C#C
• Title of publication: Synthesis of Triptycene-Based Organosoluble, Thermally Stable, and Fluorescent Polymers: Efficient Host‒Guest Complexation with Fullerene
• Authors of publication: Mondal, Snehasish; Chakraborty, Sourav; Bhowmick, Sourav; Das, Neeladri
• Journal of publication: Macromolecules
• Year of publication: 2013
• Journal volume: 46
• Journal issue: 17
• Pages of publication: 6824
• a: 8.2715 ± 0.0009 Å
• b: 10.4269 ± 0.0014 Å
• c: 19.179 ± 0.0018 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1654.1 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 2
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0401
• Residual factor for significantly intense reflections: 0.037
• Weighted residual factors for significantly intense reflections: 0.0981
• Weighted residual factors for all reflections included in the refinement: 0.1017
• Goodness-of-fit parameter for all reflections included in the refinement: 1.078
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No