Information card for entry 2214549

Structure parameters

• Chemical name: N-(5-Bromo-2-iodophenyl)-N-methylcyclopentanecarboxamide
• Formula: C13 H15 Br I N O
• Calculated formula: C13 H15 Br I N O
• Title of publication: <i>N</i>-(5-Bromo-2-iodophenyl)-<i>N</i>-methylcyclopentanecarboxamide
• Authors of publication: Slawin, Alexandra M. Z.; Nicoll, Sarah L.; Storey, John M. D.; Harrison, William T. A.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 8
• Pages of publication: o3407 - o3407
• a: 9.0116 ± 0.0014 Å
• b: 11.8073 ± 0.0018 Å
• c: 13.697 ± 0.002 Å
• α: 86.43 ± 0.012°
• β: 85.395 ± 0.013°
• γ: 78.849 ± 0.011°
• Cell volume: 1423.6 ± 0.4 ų
• Cell temperature: 93 ± 2 K
• Ambient diffraction temperature: 93 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.043
• Residual factor for significantly intense reflections: 0.0392
• Weighted residual factors for significantly intense reflections: 0.0979
• Weighted residual factors for all reflections included in the refinement: 0.1021
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes