Information card for entry 2211261

Structure parameters

• Chemical name: (E)-2-Methoxy-N'-[4-methoxy-3-(4- methylbenzenesulfonyloxy)benzylidene]benzohydrazide ethanol solvate hemihydrate
• Formula: C25 H29 N2 O7.5 S
• Calculated formula: C25 H29 N2 O7.5 S
• Title of publication: (<i>E</i>)-2-Methoxy-<i>N</i>'-[4-methoxy-3-(4-methylphenylsulfonyloxy)benzylidene]benzohydrazide ethanol solvate hemihydrate
• Authors of publication: Chen, Xin; Yu, Ming
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 12
• Pages of publication: o5503 - o5504
• a: 7.9106 ± 0.0016 Å
• b: 8.6824 ± 0.0017 Å
• c: 19.266 ± 0.004 Å
• α: 87.61 ± 0.03°
• β: 80.12 ± 0.03°
• γ: 81.39 ± 0.03°
• Cell volume: 1288.8 ± 0.5 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0771
• Residual factor for significantly intense reflections: 0.0597
• Weighted residual factors for significantly intense reflections: 0.1697
• Weighted residual factors for all reflections included in the refinement: 0.1893
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes