Information card for entry 2226503

Structure parameters

• Chemical name: <i>N</i>'-[(<i>E</i>)-1-(5-Chloro-2-hydroxyphenyl)ethylidene]pyridine-3- carbohydrazide monohydrate
• Formula: C14 H14 Cl N3 O3
• Calculated formula: C14 H14 Cl N3 O3
• SMILES: Clc1ccc(O)c(c1)/C(=N/NC(=O)c1cccnc1)C.O
• Title of publication: <i>N</i>'-[(<i>E</i>)-1-(5-Chloro-2-hydroxyphenyl)ethylidene]pyridine-3-carbohydrazide monohydrate
• Authors of publication: Hussain, Abid; Shafiq, Zahid; Tahir, M. Nawaz; Yaqub, Muhammad
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 7
• Pages of publication: o1880
• a: 7.1693 ± 0.0005 Å
• b: 7.4964 ± 0.0004 Å
• c: 14.5966 ± 0.0009 Å
• α: 90.138 ± 0.002°
• β: 95.835 ± 0.001°
• γ: 115.755 ± 0.002°
• Cell volume: 701.94 ± 0.08 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0537
• Residual factor for significantly intense reflections: 0.047
• Weighted residual factors for significantly intense reflections: 0.1309
• Weighted residual factors for all reflections included in the refinement: 0.1346
• Goodness-of-fit parameter for all reflections included in the refinement: 1.173
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes