Information card for entry 2215066

Structure parameters

• Chemical name: (<i>E</i>)-<i>N</i>'-[(5-Methylfuran-2-yl)methylene]furan-2-carbohydrazide
• Formula: C11 H10 N2 O3
• Calculated formula: C11 H10 N2 O3
• SMILES: o1c(C)ccc1/C=N/NC(=O)c1occc1
• Title of publication: (<i>E</i>)-<i>N</i>'-[(5-Methylfuran-2-yl)methylene]furan-2-carbohydrazide
• Authors of publication: Yao, Xiao-Ling; Jing, Zuo-Liang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 9
• Pages of publication: o3900 - o3900
• a: 11.402 ± 0.002 Å
• b: 7.9941 ± 0.0016 Å
• c: 24.039 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2191.1 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0601
• Residual factor for significantly intense reflections: 0.0506
• Weighted residual factors for significantly intense reflections: 0.1202
• Weighted residual factors for all reflections included in the refinement: 0.1264
• Goodness-of-fit parameter for all reflections included in the refinement: 1.116
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes