Information card for entry 2215258

Structure parameters

• Chemical name: Poly[μ~2~-L-alanine-μ~3~-nitrato-sodium(I)]
• Formula: C3 H7 N2 Na O5
• Calculated formula: C3 H7 N2 Na O5
• SMILES: C(=O)([C@H](C)[NH3+])O[Na]1ON(=[O]1)=O
• Title of publication: Poly[μ~2~-<small>L</small>-alanine-μ~3~-nitrato-sodium(I)]
• Authors of publication: Van Hecke, Kristof; Cartuyvels, Els; Parac-Vogt, Tatjana N.; Görller-Walrand, Christiane; Van Meervelt, Luc
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 9
• Pages of publication: m2354 - m2354
• a: 5.3477 ± 0.0003 Å
• b: 9.1719 ± 0.0006 Å
• c: 13.5284 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 663.55 ± 0.07 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.0388
• Residual factor for significantly intense reflections: 0.0371
• Weighted residual factors for significantly intense reflections: 0.0914
• Weighted residual factors for all reflections included in the refinement: 0.0924
• Goodness-of-fit parameter for all reflections included in the refinement: 1.095
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes