Information card for entry 2201739

Structure parameters

• Common name: Succinyl isoniazid
• Chemical name: 4-(2-isonicotinoylhydrazino)-4-oxobutanoic acid
• Formula: C10 H11 N3 O4
• Calculated formula: C10 H11 N3 O4
• SMILES: c1cnccc1C(=O)NNC(=O)CCC(=O)O
• Title of publication: 4-(2-Isonicotinoylhydrazino)-4-oxobutanoic acid
• Authors of publication: Doriguetto, Antonio C.; Paula Silva, Carlos H. T. de; Rando, Daniela G.; Ferreira, Elizabeth I.; Ellena, Javier A.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 3
• Pages of publication: o288 - o289
• a: 4.814 ± 0.0002 Å
• b: 8.9168 ± 0.0004 Å
• c: 12.4943 ± 0.0006 Å
• α: 83.797 ± 0.002°
• β: 79.735 ± 0.002°
• γ: 81.035 ± 0.002°
• Cell volume: 519.51 ± 0.04 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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 significantly intense reflections: 0.0551
• Weighted residual factors for all reflections included in the refinement: 0.1594
• Goodness-of-fit parameter for all reflections included in the refinement: 1.084
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes