Information card for entry 2236437

Structure parameters

• Common name: <i>N</i>-(Dimethoxythiophosphanoyl)cyclohexanamine
• Chemical name: <i>O</i>,<i>O</i>'-Dimethyl (cyclohexylamido)thiophosphate
• Formula: C8 H18 N O2 P S
• Calculated formula: C8 H18 N O2 P S
• Title of publication: <i>O</i>,<i>O</i>'-Dimethyl (cyclohexylamido)thiophosphate
• Authors of publication: Sabbaghi, Fahimeh; Pourayoubi, Mehrdad; Nečas, Marek
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 10
• Pages of publication: o2891
• a: 6.5214 ± 0.0004 Å
• b: 9.2078 ± 0.0006 Å
• c: 10.5763 ± 0.0007 Å
• α: 67.447 ± 0.006°
• β: 80.212 ± 0.005°
• γ: 78.863 ± 0.005°
• Cell volume: 572.24 ± 0.07 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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: 0.0311
• Residual factor for significantly intense reflections: 0.025
• Weighted residual factors for significantly intense reflections: 0.0668
• Weighted residual factors for all reflections included in the refinement: 0.0685
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes