Information card for entry 2217009

Structure parameters

• Chemical name: 4,4-Bipyridine acetic acid disolvate
• Formula: C14 H16 N2 O4
• Calculated formula: C14 H16 N2 O4
• SMILES: CC(=O)O.c1cc(ccn1)c1ccncc1.O=C(C)O
• Title of publication: 4,4'-Bipyridine acetic acid disolvate
• Authors of publication: Ling Ye
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 1
• Pages of publication: o46 - o46
• a: 3.893 ± 0.002 Å
• b: 8.181 ± 0.005 Å
• c: 22.563 ± 0.015 Å
• α: 90°
• β: 98.46 ± 0.03°
• γ: 90°
• Cell volume: 710.8 ± 0.7 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 4
• Space group number: 7
• Hermann-Mauguin space group symbol: P 1 c 1
• Hall space group symbol: P -2yc
• Residual factor for all reflections: 0.0847
• Residual factor for significantly intense reflections: 0.0499
• Weighted residual factors for significantly intense reflections: 0.1037
• Weighted residual factors for all reflections included in the refinement: 0.1188
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes