Information card for entry 2243488

Structure parameters

• Chemical name: 7,7'-[(pyridin-2-yl)methylene]bis(5-chloroquinolin-8-ol)
• Formula: C24 H15 Cl2 N3 O2
• Calculated formula: C24 H15 Cl2 N3 O2
• SMILES: Clc1c2c(nccc2)c(O)c(c1)C(c1cc(Cl)c2cccnc2c1O)c1ncccc1
• Title of publication: Crystal structure of 7,7'-[(pyridin-2-yl)methylene]bis(5-chloroquinolin-8-ol)
• Authors of publication: Kashiwagi, Yukiyasu; Kubono, Koji; Tamai, Toshiyuki
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2020
• Journal volume: 76
• Journal issue: 8
• Pages of publication: 1271 - 1274
• a: 8.7077 ± 0.0008 Å
• b: 10.4281 ± 0.001 Å
• c: 12.1329 ± 0.0011 Å
• α: 101.111 ± 0.007°
• β: 92.087 ± 0.007°
• γ: 113.161 ± 0.008°
• Cell volume: 986.22 ± 0.17 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 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: 0.0686
• Residual factor for significantly intense reflections: 0.0498
• Weighted residual factors for significantly intense reflections: 0.1096
• Weighted residual factors for all reflections included in the refinement: 0.1194
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes