Information card for entry 2204203

Structure parameters

• Chemical name: (E)-{[2-(phenyldiazenyl)phenyl]ethylideneaminooxy}acetic acid
• Formula: C16 H15 N3 O3
• Calculated formula: C16 H15 N3 O3
• SMILES: OC(=O)CON=C(C)c1c(N=Nc2ccccc2)cccc1
• Title of publication: Hydrogen-bonded <i>R</i>~2~^2^(8) dimers in (<i>E</i>)-{[2-(phenyldiazenyl)phenyl]ethylideneaminooxy}acetic acid
• Authors of publication: Glidewell, Christopher; Low, John N.; Skakle, Janet M. S.; Wardell, James L.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 9
• Pages of publication: o1560 - o1562
• a: 16.927 ± 0.002 Å
• b: 4.5244 ± 0.0005 Å
• c: 19.673 ± 0.002 Å
• α: 90°
• β: 105.828 ± 0.005°
• γ: 90°
• Cell volume: 1449.5 ± 0.3 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 4
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.1866
• Residual factor for significantly intense reflections: 0.0687
• Weighted residual factors for significantly intense reflections: 0.1444
• Weighted residual factors for all reflections included in the refinement: 0.1866
• Goodness-of-fit parameter for all reflections included in the refinement: 0.945
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes