Information card for entry 4125496

Structure parameters

• Formula: C28 H26 N2 O8 S2
• Calculated formula: C28 H26 N2 O8 S2
• SMILES: Cc1ccc(cc1)S(=O)(=O)[O-].Cc1ccc(cc1)S(=O)(=O)[O-].c1(cc2C(=O)c3ccc(cc3C(=O)c2cc1)[NH3+])[NH3+]
• Title of publication: Constructing Ultraporous Covalent Organic Frameworks in Seconds via an Organic Terracotta Process.
• Authors of publication: Karak, Suvendu; Kandambeth, Sharath; Biswal, Bishnu P.; Sasmal, Himadri Sekhar; Kumar, Sushil; Pachfule, Pradip; Banerjee, Rahul
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2017
• Journal volume: 139
• Journal issue: 5
• Pages of publication: 1856 - 1862
• a: 7.0851 ± 0.0005 Å
• b: 7.8518 ± 0.0004 Å
• c: 24.8513 ± 0.0017 Å
• α: 95.667 ± 0.005°
• β: 95.177 ± 0.006°
• γ: 93.368 ± 0.005°
• Cell volume: 1366.93 ± 0.15 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1022
• Residual factor for significantly intense reflections: 0.0637
• Weighted residual factors for significantly intense reflections: 0.1474
• Weighted residual factors for all reflections included in the refinement: 0.1684
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No