Information card for entry 2007903

Structure parameters

• Common name: 2-Nitro-4'-(N,N-dimethylamino)azobenzene
• Chemical name: (4-dimethylaminophenyl)(2-nitrophenyl)diazene
• Formula: C14 H14 N4 O2
• Calculated formula: C14 H14 N4 O2
• SMILES: O=N(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1
• Title of publication: 4'-(Dimethylamino)-2-nitroazobenzene
• Authors of publication: Zhang, De-Chun; Ge, Li-Qin; Fei, Zheng-Hao; Zhang, Yan-Qiu; Yu, Kai-Bei
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1998
• Journal volume: 54
• Journal issue: 12
• Pages of publication: 1909 - 1911
• a: 12.556 ± 0.002 Å
• b: 7.618 ± 0.001 Å
• c: 15.26 ± 0.002 Å
• α: 90°
• β: 109.76 ± 0.01°
• γ: 90°
• Cell volume: 1373.7 ± 0.3 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 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: 0.104
• Residual factor for significantly intense reflections: 0.037
• Weighted residual factors for all reflections: 0.13
• Weighted residual factors for significantly intense reflections: 0.076
• Goodness-of-fit parameter for all reflections: 0.748
• Goodness-of-fit parameter for significantly intense reflections: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes