Information card for entry 1557579

Structure parameters

• Common name: Tris(dimethylamino)Phosphanesulfide
• Formula: C6 H18 N3 P S
• Calculated formula: C6 N3 P S
• SMILES: S=P(N(C)C)(N(C)C)N(C)C
• Title of publication: Structural Characteristics of Three-Coordinate Arylhalide Tellurium(II) Complexes with Chalcogen Ligands. Synthesis, Spectroscopic Characterization and X-Ray Structural Studies of Bromo[N-methylbenzothiazole-2(3H)-selone]phenyltellurium(II), Bromophenyl[tris(dimethylamino)phosphaneselenide]tellurium(II) and Tris(dimethylamino)Phosphanesulfide
• Authors of publication: Rudd, Martin D.; Lindeman, Sergey V.; Husebye, Steinar
• Journal of publication: Acta Chemica Scandinavica
• Year of publication: 1996
• Journal volume: 50
• Pages of publication: 759 - 774
• a: 8.347 ± 0.002 Å
• b: 11.369 ± 0.002 Å
• c: 11.26 ± 0.002 Å
• α: 90°
• β: 92.94 ± 0.03°
• γ: 90°
• Cell volume: 1067.1 ± 0.4 ų
• Ambient diffraction temperature: 143 K
• Number of distinct elements: 5
• 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: 0.0635
• Residual factor for significantly intense reflections: 0.0342
• Weighted residual factors for significantly intense reflections: 0.0972
• Weighted residual factors for all reflections included in the refinement: 0.1493
• Goodness-of-fit parameter for all reflections included in the refinement: 1.073
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No