Information card for entry 2001186

Structure parameters

• Formula: C16 H11 Cl N2 O2
• Calculated formula: C16 H11 Cl N2 O2
• SMILES: Clc1ccc(cc1)/N=N/C1(C)C(=O)c2c(C1=O)cccc2
• Title of publication: 2-(4-Chlorophenylazo)-2-methyl-1,3-indandione
• Authors of publication: Özbey, S.; Kendi, E.; Hocaoğlu, N.; Uyar, T.; Mak, T. C. W.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1993
• Journal volume: 49
• Journal issue: 12
• Pages of publication: 2165 - 2167
• a: 12.424 ± 0.002 Å
• b: 14.402 ± 0.002 Å
• c: 8.09 ± 0.001 Å
• α: 90°
• β: 101.06°
• γ: 90°
• Cell volume: 1420.7 ± 0.3 ų
• Cell temperature: 293 K
• Number of distinct elements: 5
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.037
• Weighted residual factors for significantly intense reflections: 0.037
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No