Information card for entry 7060848

Structure parameters

• Formula: C78 H56 Cl8 N6 O4
• Calculated formula: C78 H56 Cl8 N6 O4
• Title of publication: Probing the performance of imide linked micro-porous polymers for enhanced CO2 gas adsorption applications
• Authors of publication: Rajendran, Narendran; Husain, Ali; Makhseed, Saad
• Journal of publication: New Journal of Chemistry
• Year of publication: 2021
• Journal volume: 45
• Journal issue: 34
• Pages of publication: 15487 - 15496
• a: 9.979 ± 0.002 Å
• b: 12.736 ± 0.003 Å
• c: 16.016 ± 0.004 Å
• α: 111.967 ± 0.008°
• β: 102.448 ± 0.007°
• γ: 93.928 ± 0.007°
• Cell volume: 1818.2 ± 0.7 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.2168
• Residual factor for significantly intense reflections: 0.0804
• Weighted residual factors for significantly intense reflections: 0.1857
• Weighted residual factors for all reflections included in the refinement: 0.2201
• Goodness-of-fit parameter for all reflections included in the refinement: 0.849
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No