Information card for entry 2231524

Structure parameters

• Chemical name: 2-[5-Methyl-2-(propan-2-yl)phenoxy]-<i>N</i>'- {2-[5-methyl-2-(propan-2-yl)phenoxy]acetyl}acetohydrazide
• Formula: C24 H32 N2 O4
• Calculated formula: C24 H32 N2 O4
• SMILES: O=C(COc1cc(C)ccc1C(C)C)NNC(=O)COc1cc(C)ccc1C(C)C
• Title of publication: 2-[5-Methyl-2-(propan-2-yl)phenoxy]-<i>N</i>'-{2-[5-methyl-2-(propan-2-yl)phenoxy]acetyl}acetohydrazide
• Authors of publication: Fun, Hoong-Kun; Quah, Ching Kheng; Nithinchandra; Kalluraya, Balakrishna
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 9
• Pages of publication: o2414
• a: 23.6018 ± 0.0008 Å
• b: 11.2077 ± 0.0004 Å
• c: 8.6653 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2292.16 ± 0.14 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 4
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.046
• Residual factor for significantly intense reflections: 0.0407
• Weighted residual factors for significantly intense reflections: 0.1066
• Weighted residual factors for all reflections included in the refinement: 0.1111
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes