Information card for entry 2210122

Structure parameters

• Chemical name: 5,5'-Dimethoxy-3,3'-(3-nitrophenylmethanediyl)bis(1H-indole)
• Formula: C25 H21 N3 O4
• Calculated formula: C25 H21 N3 O4
• SMILES: O(C)c1ccc2[nH]cc(c2c1)C(c1c[nH]c2ccc(OC)cc12)c1cccc(N(=O)=O)c1
• Title of publication: 5,5'-Dimethoxy-3,3'-(3-nitrophenylmethanediyl)bis(1<i>H</i>-indole)
• Authors of publication: Guo, Cheng; Zhang, Dong-Mei; Tang, Qing-Gang; Sun, Hong-Shun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 9
• Pages of publication: o3994 - o3995
• a: 10.631 ± 0.002 Å
• b: 9.357 ± 0.0019 Å
• c: 21.072 ± 0.004 Å
• α: 90°
• β: 92.09 ± 0.03°
• γ: 90°
• Cell volume: 2094.7 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.1059
• Residual factor for significantly intense reflections: 0.0608
• Weighted residual factors for significantly intense reflections: 0.1537
• Weighted residual factors for all reflections included in the refinement: 0.1924
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes