Information card for entry 2210838

Structure parameters

• Chemical name: 2-Methyl-1H-indole-3-carbaldehyde 4-hydrobenzoylhydrazone
• Formula: C17 H15 N3 O2
• Calculated formula: C17 H15 N3 O2
• SMILES: O=C(NN=Cc1c2c([nH]c1C)cccc2)c1ccc(O)cc1
• Title of publication: 2-Methyl-1<i>H</i>-indole-3-carbaldehyde 4-hydroxybenzoylhydrazone
• Authors of publication: Ali, Hapipah M.; Najwa, Mohd Idris; Xie, Ming-Jin; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 10
• Pages of publication: o4527 - o4528
• a: 12.171 ± 0.001 Å
• b: 14.09 ± 0.001 Å
• c: 8.6767 ± 0.0007 Å
• α: 90°
• β: 97.917 ± 0.001°
• γ: 90°
• Cell volume: 1473.8 ± 0.2 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: 0.058
• Residual factor for significantly intense reflections: 0.043
• Weighted residual factors for significantly intense reflections: 0.113
• Weighted residual factors for all reflections included in the refinement: 0.124
• 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