Information card for entry 7241412

Structure parameters

• Formula: C28 H49 N7 O2
• Calculated formula: C28 H49 N7 O2
• SMILES: N(=C1N(C(C)C)C(=C(N1C(C)C)C)C)C(N=C1N(C(=C(N1C(C)C)C)C)C(C)C)=[N+](C(=O)[O-])CCCC
• Title of publication: Highly effective capture and subsequent catalytic transformation of low-concentration CO2 by superbasic guanidines
• Authors of publication: Zhou, Hui; Chen, Wei; Liu, Ji-Hong; Zhang, Wen-Zhen; Lu, Xiao-Bing
• Journal of publication: Green Chemistry
• Year of publication: 2020
• Journal volume: 22
• Journal issue: 22
• Pages of publication: 7832 - 7838
• a: 12.003 ± 0.007 Å
• b: 19.823 ± 0.011 Å
• c: 16.309 ± 0.009 Å
• α: 90°
• β: 111.59°
• γ: 90°
• Cell volume: 3608 ± 4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1252
• Residual factor for significantly intense reflections: 0.0574
• Weighted residual factors for significantly intense reflections: 0.1321
• Weighted residual factors for all reflections included in the refinement: 0.1506
• Goodness-of-fit parameter for all reflections included in the refinement: 0.787
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No