Information card for entry 2204646

Structure parameters

• Chemical name: 4-indol-2,6-bis(4-methoxyphenyl)pyridine
• Formula: C27 H22 N2 O2
• Calculated formula: C27 H22 N2 O2
• SMILES: O(c1ccc(c2nc(cc(c2)c2c[nH]c3ccccc23)c2ccc(OC)cc2)cc1)C
• Title of publication: 4-(1<i>H</i>-Indol-3-yl)-2,6-bis(4-methoxyphenyl)pyridine
• Authors of publication: Shujiang Tu; Tuanjie Li; Fang Fang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 12
• Pages of publication: o2457 - o2459
• a: 8.7438 ± 0.0013 Å
• b: 16.341 ± 0.002 Å
• c: 16.46 ± 0.002 Å
• α: 68.442 ± 0.011°
• β: 76.059 ± 0.012°
• γ: 75.827 ± 0.012°
• Cell volume: 2090.8 ± 0.5 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0983
• Residual factor for significantly intense reflections: 0.0741
• Weighted residual factors for significantly intense reflections: 0.1352
• Weighted residual factors for all reflections included in the refinement: 0.1445
• Goodness-of-fit parameter for all reflections included in the refinement: 1.16
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No