Information card for entry 2225649

Structure parameters

• Chemical name: <i>N</i>'-(3-Methoxybenzylidene)-4-nitrobenzohydrazide monohydrate
• Formula: C15 H15 N3 O5
• Calculated formula: C15 H15 N3 O5
• SMILES: O=N(=O)c1ccc(cc1)C(=O)N/N=C/c1cc(OC)ccc1.O
• Title of publication: <i>N</i>'-(3-Methoxybenzylidene)-4-nitrobenzohydrazide monohydrate
• Authors of publication: Ahmad, Tanveer; Zia-ur-Rehman, Muhammad; Siddiqui, Hamid Latif; Fasih Ullah, Muhammad; Parvez, Masood
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 4
• Pages of publication: o977 - o978
• a: 6.7162 ± 0.0003 Å
• b: 7.4929 ± 0.0003 Å
• c: 32.1141 ± 0.0015 Å
• α: 91.883 ± 0.002°
• β: 91.5697 ± 0.0012°
• γ: 112.753 ± 0.002°
• Cell volume: 1488.12 ± 0.12 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.096
• Residual factor for significantly intense reflections: 0.071
• Weighted residual factors for significantly intense reflections: 0.1334
• Weighted residual factors for all reflections included in the refinement: 0.1486
• Goodness-of-fit parameter for all reflections included in the refinement: 1.171
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes