Information card for entry 2220911

Structure parameters

• Common name: 2-(4-Bromophenoxy)propane hydrazide
• Chemical name: 2-(4-Bromophenoxy)propanohydrazide
• Formula: C9 H11 Br N2 O2
• Calculated formula: C9 H11 Br N2 O2
• SMILES: C(=O)(NN)C(Oc1ccc(cc1)Br)C
• Title of publication: 2-(4-Bromophenoxy)propanohydrazide
• Authors of publication: Akhtar, Tashfeen; Khawar Rauf, M.; Ebihara, Masahiro; Hameed, Shahid
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 2
• Pages of publication: o441
• a: 10.2598 ± 0.0014 Å
• b: 4.8009 ± 0.0007 Å
• c: 23.322 ± 0.003 Å
• α: 90°
• β: 112.712 ± 0.006°
• γ: 90°
• Cell volume: 1059.7 ± 0.3 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 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: 0.0582
• Residual factor for significantly intense reflections: 0.0483
• Weighted residual factors for significantly intense reflections: 0.0739
• Weighted residual factors for all reflections included in the refinement: 0.0764
• Goodness-of-fit parameter for all reflections included in the refinement: 1.204
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes