Information card for entry 2207295

Structure parameters

• Chemical name: N,N-Dicyclohexyl-2-iodoacetamide
• Formula: C14 H24 I N O
• Calculated formula: C14 H24 I N O
• SMILES: C1(CCCCC1)N(C1CCCCC1)C(=O)CI
• Title of publication: <i>N</i>,<i>N</i>-Dicyclohexyl-2-iodoacetamide
• Authors of publication: Cho, Hyeon Mo; Moore, Jeffrey S.; Wilson, Scott R.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 11
• Pages of publication: o3769 - o3770
• a: 10.576 ± 0.002 Å
• b: 11.049 ± 0.002 Å
• c: 12.907 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1508.2 ± 0.5 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0299
• Residual factor for significantly intense reflections: 0.0227
• Weighted residual factors for significantly intense reflections: 0.0473
• Weighted residual factors for all reflections included in the refinement: 0.0492
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes