Information card for entry 2236793

Structure parameters

• Common name: fenoxycarb
• Chemical name: Ethyl <i>N</i>-[2-(4-phenoxyphenoxy)ethyl]carbamate
• Formula: C17 H19 N O4
• Calculated formula: C17 H19 N O4
• SMILES: O(c1ccccc1)c1ccc(OCCNC(=O)OCC)cc1
• Title of publication: Ethyl <i>N</i>-[2-(4-phenoxyphenoxy)ethyl]carbamate
• Authors of publication: Karpinska, Jolanta; Kuhs, Manuel; Rasmuson, Ake; Erxleben, Andrea; McArdle, Patrick
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 10
• Pages of publication: o2834 - o2835
• a: 5.9035 ± 0.0003 Å
• b: 7.5712 ± 0.0004 Å
• c: 35.373 ± 0.002 Å
• α: 85.618 ± 0.005°
• β: 86.213 ± 0.005°
• γ: 89.046 ± 0.004°
• Cell volume: 1572.88 ± 0.15 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1401
• Residual factor for significantly intense reflections: 0.063
• Weighted residual factors for significantly intense reflections: 0.0978
• Weighted residual factors for all reflections included in the refinement: 0.1264
• Goodness-of-fit parameter for all reflections included in the refinement: 0.966
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes