Information card for entry 2006066

Structure parameters

• Chemical name: N'-Ethoxiyarbonyl-1-Methylpyrrole-2-carbohydrazide.
• Formula: C9 H13 N3 O3
• Calculated formula: C9 H13 N3 O3
• SMILES: CCOC(=O)NNC(=O)c1cccn1C
• Title of publication: Ethyl <i>N</i>-Methyl-2-pyrrolylcarbonylhydrazinocarboxylate
• Authors of publication: Liu-Gonzalez, M.; Sanz-Ruiz, F.; Gonzalez-Rosende, M. E.; Lozano-Lucía, O.; Zaballos-García, E.; Sepulveda-Arqués, J.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1997
• Journal volume: 53
• Journal issue: 4
• Pages of publication: 490 - 491
• a: 9.363 ± 0.001 Å
• b: 9.363 ± 0.001 Å
• c: 11.015 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 836.3 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 145
• Hermann-Mauguin space group symbol: P 32
• Hall space group symbol: P 32
• Residual factor for significantly intense reflections: 0.036
• Weighted residual factors for significantly intense reflections: 0.046
• Goodness-of-fit parameter for significantly intense reflections: 1.734
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No