Information card for entry 1559333

Structure parameters

• Chemical name: 4-(Dimethylamino)benzohydrazide
• Formula: C9 H13 N3 O
• Calculated formula: C9 H13 N3 O
• SMILES: O=C(NN)c1ccc(N(C)C)cc1
• Title of publication: 4-(Dimethylamino)benzohydrazide
• Authors of publication: Kelley, Steven P.; Mossine, Valeri V.; Mawhinney, Thomas P.
• Journal of publication: IUCrData
• Year of publication: 2020
• Journal volume: 5
• Journal issue: 10
• Pages of publication: x201310
• a: 24.7018 ± 0.0006 Å
• b: 6.3093 ± 0.0001 Å
• c: 13.2103 ± 0.0003 Å
• α: 90°
• β: 118.05 ± 0.0008°
• γ: 90°
• Cell volume: 1817.01 ± 0.07 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0365
• Residual factor for significantly intense reflections: 0.0363
• Weighted residual factors for significantly intense reflections: 0.098
• Weighted residual factors for all reflections included in the refinement: 0.0982
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes