Information card for entry 2227048

Structure parameters

• Chemical name: 3-Chlorobenzohydrazide
• Formula: C7 H7 Cl N2 O
• Calculated formula: C7 H7 Cl N2 O
• SMILES: Clc1cc(ccc1)C(=O)NN
• Title of publication: 3-Chlorobenzohydrazide
• Authors of publication: Ashiq, Uzma; Jamal, Rifat Ara; Arshad, Muhammad Nadeem; Khan, Islam Ullah
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 8
• Pages of publication: o2169
• a: 16.2005 ± 0.0015 Å
• b: 3.8165 ± 0.0004 Å
• c: 12.7646 ± 0.0013 Å
• α: 90°
• β: 108.03 ± 0.005°
• γ: 90°
• Cell volume: 750.47 ± 0.13 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1003
• Residual factor for significantly intense reflections: 0.0493
• Weighted residual factors for significantly intense reflections: 0.1035
• Weighted residual factors for all reflections included in the refinement: 0.1206
• Goodness-of-fit parameter for all reflections included in the refinement: 1.007
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes