Information card for entry 2234433

Structure parameters

• Chemical name: (<i>E</i>)-2-(2-Hydroxy-5-iodobenzylidene)hydrazinecarboxamide
• Formula: C8 H8 I N3 O2
• Calculated formula: C8 H8 I N3 O2
• SMILES: Ic1cc(c(O)cc1)/C=N/NC(=O)N
• Title of publication: (<i>E</i>)-2-(2-Hydroxy-5-iodobenzylidene)hydrazinecarboxamide
• Authors of publication: Bikas, Rahman; Nikbakht Sardari, Samra; Hosseini, Seyed Sajjad; Shahverdizadeh, Gholam Hossein; Notash, Behrouz
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 4
• Pages of publication: o1090
• a: 9.1066 ± 0.0018 Å
• b: 7.6277 ± 0.0015 Å
• c: 14.375 ± 0.003 Å
• α: 90°
• β: 95.31 ± 0.03°
• γ: 90°
• Cell volume: 994.2 ± 0.3 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.0367
• Residual factor for significantly intense reflections: 0.0285
• Weighted residual factors for significantly intense reflections: 0.0543
• Weighted residual factors for all reflections included in the refinement: 0.0563
• Goodness-of-fit parameter for all reflections included in the refinement: 1.125
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes