Information card for entry 2212520

Structure parameters

• Chemical name: N-[(2,4-Dichlorophenoxy)acetyl]-N'-(dimethoxythiophosphinoyl)hydrazine
• Formula: C10 H13 Cl2 N2 O4 P S
• Calculated formula: C10 H13 Cl2 N2 O4 P S
• SMILES: c1(cc(ccc1OCC(=O)NNP(OC)(OC)=S)Cl)Cl
• Title of publication: <i>N</i>-[(2,4-Dichlorophenoxy)acetyl]-<i>N</i>'-(dimethoxythiophosphinoyl)hydrazine
• Authors of publication: Zhang, Hui-Rong; Peng, Hao; He, Hong-Wu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 3
• Pages of publication: o1080 - o1081
• a: 10.8386 ± 0.001 Å
• b: 8.4586 ± 0.0008 Å
• c: 17.2846 ± 0.0017 Å
• α: 90°
• β: 94.148 ± 0.002°
• γ: 90°
• Cell volume: 1580.5 ± 0.3 ų
• Cell temperature: 297 ± 2 K
• Ambient diffraction temperature: 297 ± 2 K
• Number of distinct elements: 7
• 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: 0.0623
• Residual factor for significantly intense reflections: 0.0518
• Weighted residual factors for significantly intense reflections: 0.129
• Weighted residual factors for all reflections included in the refinement: 0.1372
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes