Information card for entry 2206490

Structure parameters

• Common name: tert-Butylamidodichlorophosphine oxide
• Chemical name: tert-Butylamidodichlorophosphine oxide
• Formula: C4 H10 Cl2 N O P
• Calculated formula: C4 H10 Cl2 N O P
• SMILES: P(=O)(Cl)(Cl)NC(C)(C)C
• Title of publication: <i>tert</i>-Butylamidodichlorophosphine oxide
• Authors of publication: Chivers, Tristram; Grebinski, James; Parvez, Masood; Fu, Zhiyong
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 8
• Pages of publication: o2491 - o2492
• a: 8.256 ± 0.003 Å
• b: 10.219 ± 0.005 Å
• c: 11.053 ± 0.005 Å
• α: 90°
• β: 111.09 ± 0.002°
• γ: 90°
• Cell volume: 870.1 ± 0.7 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.078
• Residual factor for significantly intense reflections: 0.059
• Weighted residual factors for significantly intense reflections: 0.155
• Weighted residual factors for all reflections included in the refinement: 0.165
• Goodness-of-fit parameter for all reflections included in the refinement: 1.08
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes