Information card for entry 2223481

Structure parameters

• Chemical name: 2,9-Bis(4-pyridylmethoxy)-1,10-phenanthroline
• Formula: C24 H18 N4 O2
• Calculated formula: C24 H18 N4 O2
• SMILES: c1(ccc2c(c3c(cc2)ccc(n3)OCc2ccncc2)n1)OCc1ccncc1
• Title of publication: 2,9-Bis(4-pyridylmethoxy)-1,10-phenanthroline
• Authors of publication: Zhang, Shi Guo; Xie, Long Miao; Li, Hong
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 10
• Pages of publication: o2549
• a: 12.701 ± 0.002 Å
• b: 16.418 ± 0.003 Å
• c: 9.7443 ± 0.0016 Å
• α: 90°
• β: 107.535 ± 0.002°
• γ: 90°
• Cell volume: 1937.5 ± 0.6 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.0615
• Residual factor for significantly intense reflections: 0.0428
• Weighted residual factors for significantly intense reflections: 0.1024
• Weighted residual factors for all reflections included in the refinement: 0.1125
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes