Information card for entry 2240868

Structure parameters

• Chemical name: <i>catena</i>-Poly[[(<i>L</i>-methionine-κ<i>O</i>)zinc]-μ~3~-(hydrogen phosphato)-κ^3^<i>O</i>:<i>O</i>':<i>O</i>'']
• Formula: C5 H12 N O6 P S Zn
• Calculated formula: C5 H12 N O6 P S Zn
• SMILES: [Zn]1(OP(=O)(O)O[Zn]2OC(=O)[C@@H]([NH3+])CCSC)(OC(=O)[C@@H]([NH3+])CCSC)OP(=[O]2)(O)O[Zn]2(OC(=O)[C@@H]([NH3+])CCSC)OP(O)(=[O][Zn](OC(=O)[C@@H]([NH3+])CCSC)OP(O)(=O)O2)O1
• Title of publication: Crystal structure of a new homochiral one-dimensional zincophosphate containing <small>L</small>-methionine
• Authors of publication: Chouat, Nadjet; Hasnaoui, Mohammed Abdelkrim; Sassi, Mohamed; Bengueddach, Abdelkader; Lusvardi, Gigliola; Cornia, Andrea
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2015
• Journal volume: 71
• Journal issue: 7
• Pages of publication: 832 - 835
• a: 5.221 ± 0.0002 Å
• b: 9.1889 ± 0.0004 Å
• c: 22.1559 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1062.93 ± 0.08 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 7
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0345
• Residual factor for significantly intense reflections: 0.0258
• Weighted residual factors for significantly intense reflections: 0.0542
• Weighted residual factors for all reflections included in the refinement: 0.0564
• Goodness-of-fit parameter for all reflections included in the refinement: 1.001
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes