Information card for entry 2003349

Structure parameters

• Formula: C17 H14 N2 O2
• Calculated formula: C17 H14 N2 O2
• SMILES: Cc1ccccc1/N=N/C1(C)C(=O)c2c(C1=O)cccc2
• Title of publication: 2-Methyl-2-(2-methylphenylazo)-1,3-indandione
• Authors of publication: Özbey, S.; Kendi, E.; İde, S.; Mak, T. C. W.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 4
• Pages of publication: 707 - 709
• a: 8.205 ± 0.002 Å
• b: 14.321 ± 0.005 Å
• c: 12.838 ± 0.004 Å
• α: 90°
• β: 107.73 ± 0.02°
• γ: 90°
• Cell volume: 1436.9 ± 0.8 ų
• Cell temperature: 293 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for significantly intense reflections: 0.0529
• Weighted residual factors for significantly intense reflections: 0.0565
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No